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MS Study

Project uploaded by: Vineet K.
Project ID: IMP_100008
Title: The unique composition of Indian gut microbiome, gene catalogue and associated faecal metabolome deciphered using multi-omics approaches
Project Description: Metagenomic studies carried out in the past decade have led to an enhanced understanding of the gut microbiome in human health, however, the Indian gut microbiome is not well explored yet. We analysed the gut microbiome of 110 healthy individuals from two distinct locations (North-Central and Southern) in India using multi-omics approaches, including 16S rRNA gene amplicon sequencing, whole genome shotgun metagenomic sequencing, and metabolomic profiling of faecal and serum samples.
Research Area: Biological Sciences
Funding Source: Intramural funds from IISER Bhopal
Project Contributors: Darshan B. Dhakan, Abhijit Maji, Rituja Saxena, Vineet K. Sharma

Study uploaded by: Vineet K.
Study ID: IMS_100008
Title: The unique composition of Indian gut microbiome, gene catalogue and associated faecal metabolome deciphered using multi-omics approaches
Summary: Metagenomic studies carried out in the past decade have led to an enhanced understanding of the gut microbiome in human health, however, the Indian gut microbiome is not well explored yet. We analysed the gut microbiome of 110 healthy individuals from two distinct locations (North-Central and Southern) in India using multi-omics approaches, including 16S rRNA gene amplicon sequencing, whole genome shotgun metagenomic sequencing, and metabolomic profiling of faecal and serum samples.
Publication: The unique composition of Indian gut microbiome, gene catalogue, and associated fecal metabolome deciphered using multi-omics approaches
Release Date: May 14, 2024
Study Type: Mass Spectrometry (MS)
Data Type: Untargeted
IEC/IBSC Approval Number :

Sr.No Sample ID Sample Name Organism Source Sample Preparation Protocol Sample Type Experimental Condition Time of treatment Variant/Variety Gender Age Replicates Storage Conditions Extraction Protocol
1 IMSM_100449 HCW_S Homo sapiens blood serum N/A Healthy NA 21 NA NA

NA
2 IMSM_100448 HBM_S Homo sapiens blood serum N/A Healthy NA 23 NA NA

NA
3 IMSM_100447 HBL_S Homo sapiens blood serum N/A Healthy NA 30 NA NA

NA
4 IMSM_100446 HBK_S Homo sapiens blood serum N/A Healthy NA 21 NA NA

NA
5 IMSM_100445 HBJ_S Homo sapiens blood serum N/A Healthy NA 27 NA NA

NA
6 IMSM_100444 HBI_S Homo sapiens blood serum N/A Healthy NA 28 NA NA

NA
7 IMSM_100443 HBH_S Homo sapiens blood serum N/A Healthy NA 26 NA NA

NA
8 IMSM_100442 HBG_S Homo sapiens blood serum N/A Healthy NA 29 NA NA

NA
9 IMSM_100441 HBF_S Homo sapiens blood serum N/A Healthy NA 30 NA NA

NA
10 IMSM_100440 HBE_S Homo sapiens blood serum N/A Healthy NA 30 NA NA

NA
11 IMSM_100439 HBD_S Homo sapiens blood serum N/A Healthy NA 20 NA NA

NA
12 IMSM_100438 HBC_S Homo sapiens blood serum N/A Healthy NA 19 NA NA

NA
13 IMSM_100437 HBB_S Homo sapiens blood serum N/A Healthy NA 23 NA NA

NA
14 IMSM_100436 HBA_S Homo sapiens blood serum N/A Healthy NA 23 NA NA

NA
15 IMSM_100435 HAZ_S Homo sapiens blood serum N/A Healthy NA 23 NA NA

NA
16 IMSM_100434 HAX_S Homo sapiens blood serum N/A Healthy NA 25 NA NA

NA
17 IMSM_100433 HAV_S Homo sapiens blood serum N/A Healthy NA 24 NA NA

NA
18 IMSM_100432 HF_S Homo sapiens blood serum N/A Healthy NA 30 NA NA

NA
19 IMSM_100431 HE_S Homo sapiens blood serum N/A Healthy NA 22 NA NA

NA
20 IMSM_100430 HD_S Homo sapiens blood serum N/A Healthy NA 29 NA NA

NA
21 IMSM_100429 HB_S Homo sapiens blood serum N/A Healthy NA 23 NA NA

NA
22 IMSM_100428 HAT_S Homo sapiens blood serum N/A Healthy NA 26 NA NA

NA
23 IMSM_100427 HAR_S Homo sapiens blood serum N/A Healthy NA 28 NA NA

NA
24 IMSM_100426 HAP_S Homo sapiens blood serum N/A Healthy NA 25 NA NA

NA
25 IMSM_100425 HAI_S Homo sapiens blood serum N/A Healthy NA 24 NA NA

NA
26 IMSM_100424 HAH_S Homo sapiens blood serum N/A Healthy NA 25 NA NA

NA
27 IMSM_100423 HAG_S Homo sapiens blood serum N/A Healthy NA 23 NA NA

NA
28 IMSM_100422 HAF_S Homo sapiens blood serum N/A Healthy NA 21 NA NA

NA
29 IMSM_100421 HAE_S Homo sapiens blood serum N/A Healthy NA 21 NA NA

NA
30 IMSM_100420 HAD_S Homo sapiens blood serum N/A Healthy NA 27 NA NA

NA
31 IMSM_100419 HAC_S Homo sapiens blood serum N/A Healthy NA 21 NA NA

NA
32 IMSM_100418 HAB_S Homo sapiens blood serum N/A Healthy NA 28 NA NA

NA
33 IMSM_100417 HAA_S Homo sapiens blood serum N/A Healthy NA 27 NA NA

NA
34 IMSM_100416 HC Homo sapiens feces N/A Healthy NA 23 NA NA

NA
35 IMSM_100415 C25 Homo sapiens feces N/A Healthy NA 7 NA NA

NA
36 IMSM_100414 C24 Homo sapiens feces N/A Healthy NA 5 NA NA

NA
37 IMSM_100413 C23 Homo sapiens feces N/A Healthy NA 6 NA NA

NA
38 IMSM_100412 C22 Homo sapiens feces N/A Healthy NA 4 NA NA

NA
39 IMSM_100411 HCV Homo sapiens feces N/A Healthy NA 58 NA NA

NA
40 IMSM_100410 HCU Homo sapiens feces N/A Healthy NA 61 NA NA

NA
41 IMSM_100409 HCT Homo sapiens feces N/A Healthy NA 58 NA NA

NA
42 IMSM_100408 HCS Homo sapiens feces N/A Healthy NA 52 NA NA

NA
43 IMSM_100407 HCR Homo sapiens feces N/A Healthy NA 62 NA NA

NA
44 IMSM_100406 HCQ Homo sapiens feces N/A Healthy NA 52 NA NA

NA
45 IMSM_100405 HCP Homo sapiens feces N/A Healthy NA 71 NA NA

NA
46 IMSM_100404 HCO Homo sapiens feces N/A Healthy NA 57 NA NA

NA
47 IMSM_100403 HCN Homo sapiens feces N/A Healthy NA 57 NA NA

NA
48 IMSM_100402 HCM Homo sapiens feces N/A Healthy NA 62 NA NA

NA
49 IMSM_100401 HCL Homo sapiens feces N/A Healthy NA 64 NA NA

NA
50 IMSM_100400 HDF Homo sapiens feces N/A Healthy NA 58 NA NA

NA
51 IMSM_100399 HDE Homo sapiens feces N/A Healthy NA 30 NA NA

NA
52 IMSM_100398 HDD Homo sapiens feces N/A Healthy NA 30 NA NA

NA
53 IMSM_100397 HDC Homo sapiens feces N/A Healthy NA 27 NA NA

NA
54 IMSM_100396 HDB Homo sapiens feces N/A Healthy NA 50 NA NA

NA
55 IMSM_100395 HCZ Homo sapiens feces N/A Healthy NA 25 NA NA

NA
56 IMSM_100394 HCY Homo sapiens feces N/A Healthy NA 53 NA NA

NA
57 IMSM_100393 HCW Homo sapiens feces N/A Healthy NA 21 NA NA

NA
58 IMSM_100392 HCK Homo sapiens feces N/A Healthy NA 53 NA NA

NA
59 IMSM_100391 HCJ Homo sapiens feces N/A Healthy NA 60 NA NA

NA
60 IMSM_100390 HCI Homo sapiens feces N/A Healthy NA 53 NA NA

NA
61 IMSM_100389 HCH Homo sapiens feces N/A Healthy NA 53 NA NA

NA
62 IMSM_100388 HCF Homo sapiens feces N/A Healthy NA 58 NA NA

NA
63 IMSM_100387 HCD Homo sapiens feces N/A Healthy NA 56 NA NA

NA
64 IMSM_100386 HBZ Homo sapiens feces N/A Healthy NA 50 NA NA

NA
65 IMSM_100385 HBY Homo sapiens feces N/A Healthy NA 60 NA NA

NA
66 IMSM_100384 HBW Homo sapiens feces N/A Healthy NA 55 NA NA

NA
67 IMSM_100383 HBV Homo sapiens feces N/A Healthy NA 55 NA NA

NA
68 IMSM_100382 HBR Homo sapiens feces N/A Healthy NA 50 NA NA

NA
69 IMSM_100381 HBM Homo sapiens feces N/A Healthy NA 23 NA NA

NA
70 IMSM_100380 HBL Homo sapiens feces N/A Healthy NA 30 NA NA

NA
71 IMSM_100379 HBK Homo sapiens feces N/A Healthy NA 21 NA NA

NA
72 IMSM_100378 HBJ Homo sapiens feces N/A Healthy NA 27 NA NA

NA
73 IMSM_100377 HBI Homo sapiens feces N/A Healthy NA 28 NA NA

NA
74 IMSM_100376 HBH Homo sapiens feces N/A Healthy NA 26 NA NA

NA
75 IMSM_100375 HBG Homo sapiens feces N/A Healthy NA 29 NA NA

NA
76 IMSM_100374 HBF Homo sapiens feces N/A Healthy NA 30 NA NA

NA
77 IMSM_100373 HBE Homo sapiens feces N/A Healthy NA 30 NA NA

NA
78 IMSM_100372 HBD Homo sapiens feces N/A Healthy NA 20 NA NA

NA
79 IMSM_100371 HBC Homo sapiens feces N/A Healthy NA 19 NA NA

NA
80 IMSM_100370 HBB Homo sapiens feces N/A Healthy NA 23 NA NA

NA
81 IMSM_100369 HBA Homo sapiens feces N/A Healthy NA 23 NA NA

NA
82 IMSM_100368 HAZ Homo sapiens feces N/A Healthy NA 23 NA NA

NA
83 IMSM_100367 HAX Homo sapiens feces N/A Healthy NA 25 NA NA

NA
84 IMSM_100366 HAV Homo sapiens feces N/A Healthy NA 24 NA NA

NA
85 IMSM_100365 HAU Homo sapiens feces N/A Healthy NA 30 NA NA

NA
86 IMSM_100364 HDA Homo sapiens feces N/A Healthy NA 50 NA NA

NA
87 IMSM_100363 C9 Homo sapiens feces N/A Healthy NA 3.5 NA NA

NA
88 IMSM_100362 C7 Homo sapiens feces N/A Healthy NA 5 NA NA

NA
89 IMSM_100361 C6 Homo sapiens feces N/A Healthy NA 9 NA NA

NA
90 IMSM_100360 C5 Homo sapiens feces N/A Healthy NA 6 NA NA

NA
91 IMSM_100359 C4 Homo sapiens feces N/A Healthy NA 10 NA NA

NA
92 IMSM_100358 C3 Homo sapiens feces N/A Healthy NA 12 NA NA

NA
93 IMSM_100357 C2 Homo sapiens feces N/A Healthy NA 12 NA NA

NA
94 IMSM_100356 C19 Homo sapiens feces N/A Healthy NA 9 NA NA

NA
95 IMSM_100355 C18 Homo sapiens feces N/A Healthy NA 10 NA NA

NA
96 IMSM_100354 C16 Homo sapiens feces N/A Healthy NA 16 NA NA

NA
97 IMSM_100353 C15 Homo sapiens feces N/A Healthy NA 11 NA NA

NA
98 IMSM_100352 C14 Homo sapiens feces N/A Healthy NA 12 NA NA

NA
99 IMSM_100351 C13 Homo sapiens feces N/A Healthy NA 11 NA NA

NA
100 IMSM_100350 C10 Homo sapiens feces N/A Healthy NA 7 NA NA

NA
101 IMSM_100349 HZ Homo sapiens feces N/A Healthy NA 29 NA NA

NA
102 IMSM_100348 HY Homo sapiens feces N/A Healthy NA 0.8 NA NA

NA
103 IMSM_100347 HW Homo sapiens feces N/A Healthy NA 0.6 NA NA

NA
104 IMSM_100346 HV Homo sapiens feces N/A Healthy NA 0.6 NA NA

NA
105 IMSM_100345 HU Homo sapiens feces N/A Healthy NA 28 NA NA

NA
106 IMSM_100344 HT Homo sapiens feces N/A Healthy NA 25 NA NA

NA
107 IMSM_100343 HS Homo sapiens feces N/A Healthy NA 25 NA NA

NA
108 IMSM_100342 HR Homo sapiens feces N/A Healthy NA 26 NA NA

NA
109 IMSM_100341 HQ Homo sapiens feces N/A Healthy NA 24 NA NA

NA
110 IMSM_100340 HP Homo sapiens feces N/A Healthy NA 30 NA NA

NA
111 IMSM_100339 HO Homo sapiens feces N/A Healthy NA 26 NA NA

NA
112 IMSM_100338 HN Homo sapiens feces N/A Healthy NA 28 NA NA

NA
113 IMSM_100337 HM Homo sapiens feces N/A Healthy NA 30 NA NA

NA
114 IMSM_100336 HL Homo sapiens feces N/A Healthy NA 29 NA NA

NA
115 IMSM_100335 HK Homo sapiens feces N/A Healthy NA 26 NA NA

NA
116 IMSM_100334 HJ Homo sapiens feces N/A Healthy NA 23 NA NA

NA
117 IMSM_100333 HI Homo sapiens feces N/A Healthy NA 2.4 NA NA

NA
118 IMSM_100332 HG Homo sapiens feces N/A Healthy NA 30 NA NA

NA
119 IMSM_100331 HF Homo sapiens feces N/A Healthy NA 30 NA NA

NA
120 IMSM_100330 HE Homo sapiens feces N/A Healthy NA 22 NA NA

NA
121 IMSM_100329 HD Homo sapiens feces N/A Healthy NA 29 NA NA

NA
122 IMSM_100328 HB Homo sapiens feces N/A Healthy NA 23 NA NA

NA
123 IMSM_100327 HAT Homo sapiens feces N/A Healthy NA 26 NA NA

NA
124 IMSM_100326 HAR Homo sapiens feces N/A Healthy NA 28 NA NA

NA
125 IMSM_100325 HAP Homo sapiens feces N/A Healthy NA 25 NA NA

NA
126 IMSM_100324 HAO Homo sapiens feces N/A Healthy NA 26 NA NA

NA
127 IMSM_100323 HAN Homo sapiens feces N/A Healthy NA 26 NA NA

NA
128 IMSM_100322 HAM Homo sapiens feces NA Healthy NA 23 NA NA

NA
129 IMSM_100321 HAL Homo sapiens feces N/A Healthy NA 24 NA NA

NA
130 IMSM_100320 HAK Homo sapiens feces N/A Healthy NA 29 NA NA

NA
131 IMSM_100319 HAJ Homo sapiens feces N/A Healthy NA 22 NA NA

NA
132 IMSM_100318 HAI Homo sapiens feces N/A Healthy NA 24 NA NA

NA
133 IMSM_100317 HAH Homo sapiens feces N/A Healthy NA 25 NA NA

NA
134 IMSM_100316 HAG Homo sapiens feces N/A Healthy NA 23 NA NA

NA
135 IMSM_100315 HAF Homo sapiens feces N/A Healthy NA 21 NA NA

NA
136 IMSM_100314 HAE Homo sapiens feces N/A Healthy NA 21 NA NA

NA
137 IMSM_100313 HAD Homo sapiens feces N/A Healthy NA 27 NA NA

NA
138 IMSM_100312 HAC Homo sapiens feces N/A Healthy NA 21 NA NA

NA
139 IMSM_100311 HAB Homo sapiens feces N/A Healthy NA 28 NA NA

NA
140 IMSM_100310 HAA Homo sapiens feces N/A Healthy NA 27 NA NA

NA
141 IMSM_100201 HA Homo sapiens feces N/A Healthy NA 26 NA NA

NA

Sr.No MS Exp ID Technique Sample Name/ID Mass Spectrometer Type MS Instrument Name MS Instrument type MS Ionization Method Ion Mode/Scan Polarity Data Transformation (Software/s Used)
1 IME_100267 MS (Mass Spectrometry) HCW_S / IMSM_100449 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
2 IME_100268 MS (Mass Spectrometry) HBM_S / IMSM_100448 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
3 IME_100269 MS (Mass Spectrometry) HBL_S / IMSM_100447 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
4 IME_100270 MS (Mass Spectrometry) HBK_S / IMSM_100446 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
5 IME_100271 MS (Mass Spectrometry) HBJ_S / IMSM_100445 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
6 IME_100272 MS (Mass Spectrometry) HBI_S / IMSM_100444 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
7 IME_100273 MS (Mass Spectrometry) HBH_S / IMSM_100443 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
8 IME_100274 MS (Mass Spectrometry) HBG_S / IMSM_100442 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
9 IME_100275 MS (Mass Spectrometry) HBF_S / IMSM_100441 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
10 IME_100276 MS (Mass Spectrometry) HBE_S / IMSM_100440 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
11 IME_100277 MS (Mass Spectrometry) HBD_S / IMSM_100439 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
12 IME_100278 MS (Mass Spectrometry) HBC_S / IMSM_100438 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
13 IME_100279 MS (Mass Spectrometry) HBB_S / IMSM_100437 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
14 IME_100280 MS (Mass Spectrometry) HBA_S / IMSM_100436 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
15 IME_100281 MS (Mass Spectrometry) HAZ_S / IMSM_100435 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
16 IME_100282 MS (Mass Spectrometry) HAX_S / IMSM_100434 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
17 IME_100283 MS (Mass Spectrometry) HAV_S / IMSM_100433 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
18 IME_100284 MS (Mass Spectrometry) HF_S / IMSM_100432 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
19 IME_100285 MS (Mass Spectrometry) HE_S / IMSM_100431 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
20 IME_100286 MS (Mass Spectrometry) HD_S / IMSM_100430 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
21 IME_100287 MS (Mass Spectrometry) HB_S / IMSM_100429 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
22 IME_100288 MS (Mass Spectrometry) HAT_S / IMSM_100428 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
23 IME_100289 MS (Mass Spectrometry) HAR_S / IMSM_100427 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
24 IME_100290 MS (Mass Spectrometry) HAP_S / IMSM_100426 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
25 IME_100291 MS (Mass Spectrometry) HAI_S / IMSM_100425 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
26 IME_100292 MS (Mass Spectrometry) HAH_S / IMSM_100424 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
27 IME_100293 MS (Mass Spectrometry) HAG_S / IMSM_100423 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
28 IME_100294 MS (Mass Spectrometry) HAF_S / IMSM_100422 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
29 IME_100295 MS (Mass Spectrometry) HAE_S / IMSM_100421 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
30 IME_100296 MS (Mass Spectrometry) HAD_S / IMSM_100420 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
31 IME_100297 MS (Mass Spectrometry) HAC_S / IMSM_100419 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
32 IME_100298 MS (Mass Spectrometry) HAB_S / IMSM_100418 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
33 IME_100299 MS (Mass Spectrometry) HAA_S / IMSM_100417 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
34 IME_100300 MS (Mass Spectrometry) HC / IMSM_100416 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
35 IME_100301 MS (Mass Spectrometry) C25 / IMSM_100415 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
36 IME_100302 MS (Mass Spectrometry) C24 / IMSM_100414 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
37 IME_100303 MS (Mass Spectrometry) C23 / IMSM_100413 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
38 IME_100304 MS (Mass Spectrometry) C22 / IMSM_100412 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
39 IME_100305 MS (Mass Spectrometry) HCV / IMSM_100411 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
40 IME_100306 MS (Mass Spectrometry) HCU / IMSM_100410 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
41 IME_100307 MS (Mass Spectrometry) HCT / IMSM_100409 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
42 IME_100308 MS (Mass Spectrometry) HCS / IMSM_100408 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
43 IME_100309 MS (Mass Spectrometry) HCR / IMSM_100407 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
44 IME_100310 MS (Mass Spectrometry) HCQ / IMSM_100406 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
45 IME_100311 MS (Mass Spectrometry) HCP / IMSM_100405 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
46 IME_100312 MS (Mass Spectrometry) HCO / IMSM_100404 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
47 IME_100313 MS (Mass Spectrometry) HCN / IMSM_100403 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
48 IME_100314 MS (Mass Spectrometry) HCM / IMSM_100402 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
49 IME_100315 MS (Mass Spectrometry) HCL / IMSM_100401 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
50 IME_100316 MS (Mass Spectrometry) HDF / IMSM_100400 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
51 IME_100317 MS (Mass Spectrometry) HDE / IMSM_100399 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
52 IME_100318 MS (Mass Spectrometry) HDD / IMSM_100398 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
53 IME_100319 MS (Mass Spectrometry) HDC / IMSM_100397 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
54 IME_100320 MS (Mass Spectrometry) HDB / IMSM_100396 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
55 IME_100321 MS (Mass Spectrometry) HCZ / IMSM_100395 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
56 IME_100322 MS (Mass Spectrometry) HCY / IMSM_100394 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
57 IME_100323 MS (Mass Spectrometry) HCW / IMSM_100393 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
58 IME_100324 MS (Mass Spectrometry) HCK / IMSM_100392 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
59 IME_100325 MS (Mass Spectrometry) HCJ / IMSM_100391 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
60 IME_100326 MS (Mass Spectrometry) HCI / IMSM_100390 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
61 IME_100327 MS (Mass Spectrometry) HCH / IMSM_100389 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
62 IME_100328 MS (Mass Spectrometry) HCF / IMSM_100388 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
63 IME_100329 MS (Mass Spectrometry) HCD / IMSM_100387 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
64 IME_100330 MS (Mass Spectrometry) HBZ / IMSM_100386 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
65 IME_100331 MS (Mass Spectrometry) HBY / IMSM_100385 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
66 IME_100332 MS (Mass Spectrometry) HBW / IMSM_100384 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
67 IME_100333 MS (Mass Spectrometry) HBV / IMSM_100383 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
68 IME_100334 MS (Mass Spectrometry) HBR / IMSM_100382 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
69 IME_100335 MS (Mass Spectrometry) HBM / IMSM_100381 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
70 IME_100336 MS (Mass Spectrometry) HBL / IMSM_100380 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
71 IME_100337 MS (Mass Spectrometry) HBK / IMSM_100379 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
72 IME_100338 MS (Mass Spectrometry) HBJ / IMSM_100378 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
73 IME_100339 MS (Mass Spectrometry) HBI / IMSM_100377 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
74 IME_100340 MS (Mass Spectrometry) HBH / IMSM_100376 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
75 IME_100341 MS (Mass Spectrometry) HBG / IMSM_100375 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
76 IME_100342 MS (Mass Spectrometry) HBF / IMSM_100374 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
77 IME_100343 MS (Mass Spectrometry) HBE / IMSM_100373 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
78 IME_100344 MS (Mass Spectrometry) HBD / IMSM_100372 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
79 IME_100345 MS (Mass Spectrometry) HBC / IMSM_100371 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
80 IME_100346 MS (Mass Spectrometry) HBB / IMSM_100370 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
81 IME_100347 MS (Mass Spectrometry) HBA / IMSM_100369 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
82 IME_100348 MS (Mass Spectrometry) HAZ / IMSM_100368 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
83 IME_100349 MS (Mass Spectrometry) HAX / IMSM_100367 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
84 IME_100350 MS (Mass Spectrometry) HAV / IMSM_100366 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
85 IME_100351 MS (Mass Spectrometry) HAU / IMSM_100365 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
86 IME_100352 MS (Mass Spectrometry) HDA / IMSM_100364 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
87 IME_100353 MS (Mass Spectrometry) C9 / IMSM_100363 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
88 IME_100354 MS (Mass Spectrometry) C7 / IMSM_100362 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
89 IME_100355 MS (Mass Spectrometry) C6 / IMSM_100361 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
90 IME_100356 MS (Mass Spectrometry) C5 / IMSM_100360 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
91 IME_100357 MS (Mass Spectrometry) C4 / IMSM_100359 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
92 IME_100358 MS (Mass Spectrometry) C3 / IMSM_100358 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
93 IME_100359 MS (Mass Spectrometry) C2 / IMSM_100357 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
94 IME_100360 MS (Mass Spectrometry) C19 / IMSM_100356 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
95 IME_100361 MS (Mass Spectrometry) C18 / IMSM_100355 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
96 IME_100362 MS (Mass Spectrometry) C16 / IMSM_100354 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
97 IME_100363 MS (Mass Spectrometry) C15 / IMSM_100353 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
98 IME_100364 MS (Mass Spectrometry) C14 / IMSM_100352 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
99 IME_100365 MS (Mass Spectrometry) C13 / IMSM_100351 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
100 IME_100366 MS (Mass Spectrometry) C10 / IMSM_100350 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
101 IME_100367 MS (Mass Spectrometry) HZ / IMSM_100349 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
102 IME_100368 MS (Mass Spectrometry) HY / IMSM_100348 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
103 IME_100369 MS (Mass Spectrometry) HW / IMSM_100347 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
104 IME_100370 MS (Mass Spectrometry) HV / IMSM_100346 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
105 IME_100371 MS (Mass Spectrometry) HU / IMSM_100345 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
106 IME_100372 MS (Mass Spectrometry) HT / IMSM_100344 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
107 IME_100373 MS (Mass Spectrometry) HS / IMSM_100343 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
108 IME_100374 MS (Mass Spectrometry) HR / IMSM_100342 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
109 IME_100375 MS (Mass Spectrometry) HQ / IMSM_100341 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
110 IME_100376 MS (Mass Spectrometry) HP / IMSM_100340 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
111 IME_100377 MS (Mass Spectrometry) HO / IMSM_100339 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
112 IME_100378 MS (Mass Spectrometry) HN / IMSM_100338 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
113 IME_100379 MS (Mass Spectrometry) HM / IMSM_100337 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
114 IME_100380 MS (Mass Spectrometry) HL / IMSM_100336 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
115 IME_100381 MS (Mass Spectrometry) HK / IMSM_100335 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
116 IME_100382 MS (Mass Spectrometry) HJ / IMSM_100334 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
117 IME_100383 MS (Mass Spectrometry) HI / IMSM_100333 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
118 IME_100384 MS (Mass Spectrometry) HG / IMSM_100332 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
119 IME_100385 MS (Mass Spectrometry) HF / IMSM_100331 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
120 IME_100386 MS (Mass Spectrometry) HE / IMSM_100330 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
121 IME_100387 MS (Mass Spectrometry) HD / IMSM_100329 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
122 IME_100388 MS (Mass Spectrometry) HB / IMSM_100328 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
123 IME_100389 MS (Mass Spectrometry) HAT / IMSM_100327 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
124 IME_100390 MS (Mass Spectrometry) HAR / IMSM_100326 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
125 IME_100391 MS (Mass Spectrometry) HAP / IMSM_100325 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
126 IME_100392 MS (Mass Spectrometry) HAO / IMSM_100324 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
127 IME_100393 MS (Mass Spectrometry) HAN / IMSM_100323 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
128 IME_100394 MS (Mass Spectrometry) HAM / IMSM_100322 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
129 IME_100395 MS (Mass Spectrometry) HAL / IMSM_100321 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
130 IME_100396 MS (Mass Spectrometry) HAK / IMSM_100320 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
131 IME_100397 MS (Mass Spectrometry) HAJ / IMSM_100319 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
132 IME_100398 MS (Mass Spectrometry) HAI / IMSM_100318 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
133 IME_100399 MS (Mass Spectrometry) HAH / IMSM_100317 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
134 IME_100400 MS (Mass Spectrometry) HAG / IMSM_100316 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
135 IME_100401 MS (Mass Spectrometry) HAF / IMSM_100315 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
136 IME_100402 MS (Mass Spectrometry) HAE / IMSM_100314 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
137 IME_100403 MS (Mass Spectrometry) HAD / IMSM_100313 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
138 IME_100404 MS (Mass Spectrometry) HAC / IMSM_100312 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
139 IME_100405 MS (Mass Spectrometry) HAB / IMSM_100311 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
140 IME_100406 MS (Mass Spectrometry) HAA / IMSM_100310 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A
141 IME_100407 MS (Mass Spectrometry) HA / IMSM_100201 GCMS (Gas Chromatography -Mass Spectrometry) Agilent 5975C Single quadrupole Electron Ionization - EI Positive N/A

Sr.No First name Last name Email Organization Designation
1 Vineet K. Sharma vineetks@iiserb.ac.in Indian Institute of Science Education and Research, Bhopal principal_investigator
2 Rituja Saxena ritujaritu@gmail.com Indian Institute of Science Education and Research, Bhopal research_scholar
3 Abhijit Maji abhi71084@gmail.com Indian Institute of Science Education and Research, Bhopal postdoctoral_researcher
4 Darshan B. Dhakan dardhakkan@gmail.com Indian Institute of Science Education and Research, Bhopal research_scholar

Sr.No ftprun ID MS Exp ID MS Data Files
1 IMR_100866 IME_100267 SAMN07449070_S.CDF
2 IMR_100867 IME_100268 SAMN07449056_S.CDF
3 IMR_100868 IME_100269 SAMN07449055_S.CDF
4 IMR_100869 IME_100270 SAMN07449054_S.CDF
5 IMR_100870 IME_100271 SAMN07449053_S.CDF
6 IMR_100871 IME_100272 SAMN07449052_S.CDF
7 IMR_100872 IME_100273 SAMN07449051_S.CDF
8 IMR_100873 IME_100274 SAMN07449050_S.CDF
9 IMR_100874 IME_100275 SAMN07449049_S.CDF
10 IMR_100875 IME_100276 SAMN07449048_S.CDF
11 IMR_100876 IME_100277 SAMN07449047_S.CDF
12 IMR_100877 IME_100278 SAMN07449046_S.CDF
13 IMR_100878 IME_100279 SAMN07449045_S.CDF
14 IMR_100879 IME_100280 SAMN07449044_S.CDF
15 IMR_100880 IME_100281 SAMN07449043_S.CDF
16 IMR_100881 IME_100282 SAMN07449042_S.CDF
17 IMR_100882 IME_100283 SAMN07449041_S.CDF
18 IMR_100883 IME_100284 SAMN07449002_S.CDF
19 IMR_100884 IME_100285 SAMN07449001_S.CDF
20 IMR_100885 IME_100286 SAMN07449000_S.CDF
21 IMR_100886 IME_100287 SAMN07448987_S.CDF
22 IMR_100887 IME_100288 SAMN07448986_S.CDF
23 IMR_100888 IME_100289 SAMN07448985_S.CDF
24 IMR_100889 IME_100290 SAMN07448984_S.CDF
25 IMR_100890 IME_100291 SAMN07448977_S.CDF
26 IMR_100891 IME_100292 SAMN07448976_S.CDF
27 IMR_100892 IME_100293 SAMN07448975_S.CDF
28 IMR_100893 IME_100294 SAMN07448974_S.CDF
29 IMR_100894 IME_100295 SAMN07448973_S.CDF
30 IMR_100895 IME_100296 SAMN07448972_S.CDF
31 IMR_100896 IME_100297 SAMN07448971_S.CDF
32 IMR_100897 IME_100298 SAMN07448970_S.CDF
33 IMR_100898 IME_100299 SAMN07448969_S.CDF
34 IMR_100899 IME_100300 SAMN07448988.CDF
35 IMR_100900 IME_100301 SAMN07449031.CDF
36 IMR_100901 IME_100302 SAMN07449030.CDF
37 IMR_100902 IME_100303 SAMN07449029.CDF
38 IMR_100903 IME_100304 SAMN07449028.CDF
39 IMR_100904 IME_100305 SAMN07448999.CDF
40 IMR_100905 IME_100306 SAMN07448998.CDF
41 IMR_100906 IME_100307 SAMN07448997.CDF
42 IMR_100907 IME_100308 SAMN07448996.CDF
43 IMR_100908 IME_100309 SAMN07448995.CDF
44 IMR_100909 IME_100310 SAMN07448994.CDF
45 IMR_100910 IME_100311 SAMN07448993.CDF
46 IMR_100911 IME_100312 SAMN07448992.CDF
47 IMR_100912 IME_100313 SAMN07448991.CDF
48 IMR_100913 IME_100314 SAMN07448990.CDF
49 IMR_100914 IME_100315 SAMN07448989.CDF
50 IMR_100915 IME_100316 SAMN07449077.CDF
51 IMR_100916 IME_100317 SAMN07449076.CDF
52 IMR_100917 IME_100318 SAMN07449075.CDF
53 IMR_100918 IME_100319 SAMN07449074.CDF
54 IMR_100919 IME_100320 SAMN07449073.CDF
55 IMR_100920 IME_100321 SAMN07449072.CDF
56 IMR_100921 IME_100322 SAMN07449071.CDF
57 IMR_100922 IME_100323 SAMN07449070.CDF
58 IMR_100923 IME_100324 SAMN07449069.CDF
59 IMR_100924 IME_100325 SAMN07449068.CDF
60 IMR_100925 IME_100326 SAMN07449067.CDF
61 IMR_100926 IME_100327 SAMN07449066.CDF
62 IMR_100927 IME_100328 SAMN07449065.CDF
63 IMR_100928 IME_100329 SAMN07449064.CDF
64 IMR_100929 IME_100330 SAMN07449061.CDF
65 IMR_100930 IME_100331 SAMN07449060.CDF
66 IMR_100931 IME_100332 SAMN07449059.CDF
67 IMR_100932 IME_100333 SAMN07449058.CDF
68 IMR_100933 IME_100334 SAMN07449057.CDF
69 IMR_100934 IME_100335 SAMN07449056.CDF
70 IMR_100935 IME_100336 SAMN07449055.CDF
71 IMR_100936 IME_100337 SAMN07449054.CDF
72 IMR_100937 IME_100338 SAMN07449053.CDF
73 IMR_100938 IME_100339 SAMN07449052.CDF
74 IMR_100939 IME_100340 SAMN07449051.CDF
75 IMR_100940 IME_100341 SAMN07449050.CDF
76 IMR_100941 IME_100342 SAMN07449049.CDF
77 IMR_100942 IME_100343 SAMN07449048.CDF
78 IMR_100943 IME_100344 SAMN07449047.CDF
79 IMR_100944 IME_100345 SAMN07449046.CDF
80 IMR_100945 IME_100346 SAMN07449045.CDF
81 IMR_100946 IME_100347 SAMN07449044.CDF
82 IMR_100947 IME_100348 SAMN07449043.CDF
83 IMR_100948 IME_100349 SAMN07449042.CDF
84 IMR_100949 IME_100350 SAMN07449041.CDF
85 IMR_100950 IME_100351 SAMN07449040.CDF
86 IMR_100951 IME_100352 SAMN07449039.CDF
87 IMR_100952 IME_100353 SAMN07449037.CDF
88 IMR_100953 IME_100354 SAMN07449036.CDF
89 IMR_100954 IME_100355 SAMN07449035.CDF
90 IMR_100955 IME_100356 SAMN07449034.CDF
91 IMR_100956 IME_100357 SAMN07449033.CDF
92 IMR_100957 IME_100358 SAMN07449032.CDF
93 IMR_100958 IME_100359 SAMN07449027.CDF
94 IMR_100959 IME_100360 SAMN07449026.CDF
95 IMR_100960 IME_100361 SAMN07449038.CDF
96 IMR_100961 IME_100362 SAMN07449025.CDF
97 IMR_100962 IME_100363 SAMN07449024.CDF
98 IMR_100963 IME_100364 SAMN07449023.CDF
99 IMR_100964 IME_100365 SAMN07449022.CDF
100 IMR_100965 IME_100366 SAMN07449021.CDF
101 IMR_100966 IME_100367 SAMN07449020.CDF
102 IMR_100967 IME_100368 SAMN07449019.CDF
103 IMR_100968 IME_100369 SAMN07449018.CDF
104 IMR_100969 IME_100370 SAMN07449017.CDF
105 IMR_100970 IME_100371 SAMN07449016.CDF
106 IMR_100971 IME_100372 SAMN07449015.CDF
107 IMR_100972 IME_100373 SAMN07449014.CDF
108 IMR_100973 IME_100374 SAMN07449013.CDF
109 IMR_100974 IME_100375 SAMN07449012.CDF
110 IMR_100975 IME_100376 SAMN07449011.CDF
111 IMR_100976 IME_100377 SAMN07449010.CDF
112 IMR_100977 IME_100378 SAMN07449009.CDF
113 IMR_100978 IME_100379 SAMN07449008.CDF
114 IMR_100979 IME_100380 SAMN07449007.CDF
115 IMR_100980 IME_100381 SAMN07449006.CDF
116 IMR_100981 IME_100382 SAMN07449005.CDF
117 IMR_100982 IME_100383 SAMN07449004.CDF
118 IMR_100983 IME_100384 SAMN07449003.CDF
119 IMR_100984 IME_100385 SAMN07449002.CDF
120 IMR_100985 IME_100386 SAMN07449001.CDF
121 IMR_100986 IME_100387 SAMN07449000.CDF
122 IMR_100987 IME_100388 SAMN07448987.CDF
123 IMR_100988 IME_100389 SAMN07448986.CDF
124 IMR_100989 IME_100390 SAMN07448985.CDF
125 IMR_100990 IME_100391 SAMN07448984.CDF
126 IMR_100991 IME_100392 SAMN07448983.CDF
127 IMR_100992 IME_100393 SAMN07448982.CDF
128 IMR_100993 IME_100394 SAMN07448981.CDF
129 IMR_100994 IME_100395 SAMN07448980.CDF
130 IMR_100995 IME_100396 SAMN07448979.CDF
131 IMR_100996 IME_100397 SAMN07448978.CDF
132 IMR_100997 IME_100398 SAMN07448977.CDF
133 IMR_100998 IME_100399 SAMN07448976.CDF
134 IMR_100999 IME_100400 SAMN07448975.CDF
135 IMR_101000 IME_100401 SAMN07448974.CDF
136 IMR_101001 IME_100402 SAMN07448973.CDF
137 IMR_101002 IME_100403 SAMN07448972.CDF
138 IMR_101003 IME_100404 SAMN07448971.CDF
139 IMR_101004 IME_100405 SAMN07448970.CDF
140 IMR_101005 IME_100406 SAMN07448969.CDF
141 IMR_101006 IME_100407 SAMN07448968.CDF

Metabolite/Compound File: SERUM_STOOL_mass_spectrometry_maf.tsv
Sr.No Structure Details
1 Molecular Structure

Valeric acid

CHEBI ID: CHEBI:17418

PubChem ID: 10449

Chemical Formula: C5H10O2

Smiles: CCCCC(O)=O

InChI: InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)

Mass to charge: 159.1

Retention Time: 268
2 Molecular Structure

beta-Hydroxy butyric acid

CHEBI ID: CHEBI:20067

PubChem ID: 441

Chemical Formula: C4H8O3

Smiles: CC(O)CC(O)=O

InChI: InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)

Mass to charge: 117.1

Retention Time: 328
3 Molecular Structure

Alanine

CHEBI ID: CHEBI:16449

PubChem ID: 5950

Chemical Formula: C3H7NO2

Smiles: CC(N)C(O)=O

InChI: InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)

Mass to charge: 101.8

Retention Time: 363
4 Molecular Structure

Valine

CHEBI ID: CHEBI:27266

PubChem ID: 6287

Chemical Formula: C5H11NO2

Smiles: CC(C)C(N)C(O)=O

InChI: InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)

Mass to charge: 144.1

Retention Time: 458
5 Molecular Structure

L-Leucine

CHEBI ID: CHEBI:15603

PubChem ID: 6106

Chemical Formula: C6H13NO2

Smiles: CC(C)C[C@H](N)C(O)=O

InChI: InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1

Mass to charge: 159.1

Retention Time: 505
6 Molecular Structure

L-isoleucine

CHEBI ID: CHEBI:17191

PubChem ID: 6306

Chemical Formula: C6H13NO2

Smiles: CC[C@H](C)[C@H](N)C(O)=O

InChI: InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1

Mass to charge: 158.1

Retention Time: 524
7 Molecular Structure

Glycine

CHEBI ID: CHEBI:15428

PubChem ID: 750

Chemical Formula: C2H5NO2

Smiles: NCC(O)=O

InChI: InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)

Mass to charge: 174.1

Retention Time: 536
8 Molecular Structure

Mannose

CHEBI ID: CHEBI:37684

PubChem ID: 18950

Chemical Formula: C6H12O6

Smiles: C([C@@H]1[C@H]([C@@H]([C@@H](C(O1)O)O)O)O)O

InChI: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5+,6?/m1/s1

Mass to charge: 173.0

Retention Time: 976
9 Molecular Structure

Glucose

CHEBI ID: CHEBI:17234

PubChem ID: 5793

Chemical Formula: C6H12O6

Smiles: C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)O)O)O)O

InChI: InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1

Mass to charge: 173.0

Retention Time: 976
10 Molecular Structure

Palmitic acid

CHEBI ID: CHEBI:15756

PubChem ID: 985

Chemical Formula: C16H32O2

Smiles: CCCCCCCCCCCCCCCC(O)=O

InChI: InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)

Mass to charge: 313.2

Retention Time: 1045
11 Molecular Structure

Stearic acid

CHEBI ID: CHEBI:28842

PubChem ID: 5281

Chemical Formula: C18H36O2

Smiles: C(CCCCCCCCCC)CCCCCCC(=O)O

InChI: InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)

Mass to charge: 117.0

Retention Time: 1155