| NPC224765 |
AFHJQYHRLPMKHU-GCLVLASRSA-N |
n.a. |
0 |
0 |
| NPC97359 |
PUPZLCDOIYMWBV-BYPYZUCNSA-N |
n.a. |
1 |
2 |
| NPC278310 |
OWBTYPJTUOEWEK-QWWZWVQMSA-N |
n.a. |
0 |
0 |
| NPC267946 |
HOGWBMWOBRRKCD-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC114310 |
Isonicotinic Acid |
pyridine-4-carboxylic acid |
5 |
8 |
| NPC218866 |
Aloin B |
(10R)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one |
1 |
3 |
| NPC217226 |
Furfural |
furan-2-carbaldehyde |
14 |
35 |
| NPC100742 |
Tartaric Acid |
(2S,3S)-2,3-dihydroxybutanedioic acid |
8 |
13 |
| NPC163105 |
Thymine |
5-methyl-1H-pyrimidine-2,4-dione |
8 |
8 |
| NPC20791 |
Quercetin |
2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxychromen-4-one |
553 |
2064 |
| NPC83723 |
3-Methylbutan-2-One |
3-methylbutan-2-one |
1 |
2 |
| NPC263125 |
BUPDVJFRVYWYEV-PIVIZACJSA-N |
n.a. |
0 |
0 |
| NPC130683 |
Sucrose |
(2R,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol |
28 |
62 |
| NPC100749 |
FEWJPZIEWOKRBE-LWMBPPNESA-L |
n.a. |
0 |
0 |
| NPC219876 |
Cianidanol |
(2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol |
166 |
317 |
| NPC111138 |
JRHWHSJDIILJAT-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC126029 |
(-)-Epicatechin |
(2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol |
114 |
281 |
| NPC287876 |
Xanthine |
3,7-dihydropurine-2,6-dione |
14 |
25 |
| NPC201844 |
Dodecanoate |
dodecanoic acid |
50 |
131 |
| NPC195312 |
OUGNWRCWQLUXHX-ACWXGELRSA-N |
n.a. |
0 |
0 |
| NPC70622 |
Aloe-Emodin |
1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione |
107 |
166 |
| NPC146289 |
Acetaldehyde |
acetaldehyde |
18 |
75 |
| NPC290563 |
Erucic Acid |
(Z)-docos-13-enoic acid |
76 |
91 |
| NPC33489 |
2-Nonenal |
(E)-non-2-enal |
18 |
24 |
| NPC192402 |
Malic Acid |
2-hydroxybutanedioic acid |
12 |
18 |
| NPC201385 |
KFJNVVJUICKJEQ-LQDZTQBFSA-N |
n.a. |
0 |
0 |
| NPC149184 |
Elcosanoic Acid |
icosanoic acid |
9 |
11 |
| NPC261831 |
Oleic Acid |
(Z)-octadec-9-enoic acid |
128 |
256 |
| NPC173637 |
Quercitrin |
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one |
53 |
124 |
| NPC164646 |
Pentanal |
pentanal |
11 |
13 |
| NPC190810 |
(-)-Limonene |
(4S)-1-methyl-4-prop-1-en-2-ylcyclohexene |
3 |
8 |
| NPC111275 |
Indole-3-Acetic Acid |
2-(1H-indol-3-yl)acetic acid |
20 |
50 |
| NPC241850 |
XLMFDCKSFJWJTP-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC131981 |
Camphor |
(1R,4R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one |
41 |
136 |
| NPC210529 |
(2R)-2-Hydroxy-2-Phenylacetic Acid |
(2R)-2-hydroxy-2-phenylacetic acid |
8 |
15 |
| NPC221192 |
Octan-2-One |
octan-2-one |
2 |
2 |
| NPC104195 |
3-Methylbutanoic Acid |
3-methylbutanoic acid |
5 |
11 |
| NPC59586 |
DDCAYMMIVGRVHF-QTTNIMKZSA-N |
n.a. |
0 |
0 |
| NPC146197 |
ZQPPMHVWECSIRJ-FGFBQCSHSA-N |
n.a. |
0 |
0 |
| NPC232106 |
BCTBAGTXFYWYMW-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC281020 |
Homovanillic Acid |
2-(4-hydroxy-3-methoxyphenyl)acetic acid |
26 |
50 |
| NPC300228 |
CKDDRHZIAZRDBW-UHFFFAOYSA-N |
n.a. |
1 |
1 |
| NPC78551 |
Beta-Pinene |
6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane |
11 |
53 |
| NPC64777 |
AFENDNXGAFYKQO-VKHMYHEASA-N |
n.a. |
0 |
0 |
| NPC79291 |
ODHCTXKNWHHXJC-GSVOUGTGSA-N |
n.a. |
0 |
0 |
| NPC163707 |
Isopropyl Alcohol |
propan-2-ol |
15 |
41 |
| NPC160548 |
Mandelic Acid |
2-hydroxy-2-phenylacetic acid |
16 |
18 |
| NPC13426 |
2-(2-Hydroxyphenyl)Acetate |
2-(2-hydroxyphenyl)acetic acid |
2 |
2 |
| NPC94901 |
FAMJUFMHYAFYNU-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC289758 |
Glucose, Liquid |
(3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol |
24 |
63 |
| NPC27699 |
Uracil |
1H-pyrimidine-2,4-dione |
71 |
89 |
| NPC34589 |
NDFKTBCGKNOHPJ-WAYWQWQTSA-N |
n.a. |
0 |
0 |
| NPC424 |
Elaidic Acid |
(E)-octadec-9-enoic acid |
12 |
27 |
| NPC304927 |
2-Methylbutanal |
2-methylbutanal |
2 |
11 |
| NPC49151 |
Nonanal |
nonanal |
3 |
17 |
| NPC301585 |
Myristic Acid |
tetradecanoic acid |
46 |
128 |
| NPC187770 |
Ascorbate |
(2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one |
62 |
1115 |
| NPC312800 |
Gentisic Acid |
2,5-dihydroxybenzoic acid |
28 |
42 |
| NPC280073 |
QQZOPKMRPOGIEB-UHFFFAOYSA-N |
n.a. |
1 |
1 |
| NPC261619 |
(+)-Epicatechin |
(2S,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol |
11 |
20 |
| NPC19576 |
Pyroglutamic Acid |
(2S)-5-oxopyrrolidine-2-carboxylic acid |
14 |
30 |
| NPC36061 |
Palmitoleic Acid |
(Z)-hexadec-9-enoic acid |
18 |
37 |
| NPC79482 |
QPRQEDXDYOZYLA-YFKPBYRVSA-N |
n.a. |
0 |
0 |
| NPC243579 |
DPLGXGDPPMLJHN-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC53092 |
LNDWMQWLWGXEET-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC262505 |
Decanal |
decanal |
3 |
16 |
| NPC141986 |
Pentan-2-One |
pentan-2-one |
3 |
9 |
| NPC59712 |
YONLFQNRGZXBBF-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC48130 |
Aloin |
1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one |
10 |
14 |
| NPC29950 |
Pidolic Acid |
5-oxopyrrolidine-2-carboxylic acid |
5 |
9 |
| NPC100980 |
Phenol |
phenol |
57 |
250 |
| NPC1075 |
(Z)-3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid |
(Z)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid |
9 |
19 |
| NPC132565 |
MWMPEAHGUXCSMY-UHFFFAOYSA-N |
n.a. |
2 |
4 |
| NPC178595 |
JVTAAEKCZFNVCJ-REOHCLBHSA-N |
n.a. |
5 |
6 |
| NPC311000 |
Propanol |
propan-1-ol |
12 |
33 |
| NPC5505 |
2-Hydroxybutyric Acid |
2-hydroxybutanoic acid |
5 |
5 |
| NPC227267 |
Oxolan-2-Ylmethanol |
oxolan-2-ylmethanol |
1 |
7 |
| NPC19256 |
Anthraquinone |
anthracene-9,10-dione |
40 |
65 |
| NPC268826 |
Octanedioate |
octanedioic acid |
4 |
9 |
| NPC32279 |
Heptanal |
heptanal |
7 |
18 |
| NPC196250 |
CPGZKTYDQWDELD-MKNNQNITSA-N |
n.a. |
0 |
0 |
| NPC56050 |
MKLARKDYEBNZFK-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC173996 |
4,7,7-Trimethylbicyclo[2.2.1]Heptan-3-One |
4,7,7-trimethylbicyclo[2.2.1]heptan-3-one |
5 |
11 |
| NPC23071 |
2-Methylbutan-1-Ol |
2-methylbutan-1-ol |
4 |
12 |
| NPC18188 |
Gamma-Aminobutyric Acid |
4-aminobutanoic acid |
84 |
422 |
| NPC200333 |
Acetone |
propan-2-one |
12 |
229 |
| NPC85813 |
Linoleic Acid |
(9Z,12Z)-octadeca-9,12-dienoic acid |
60 |
235 |
| NPC70756 |
[14C]-Fructose |
(3S,4R,5R)-2-(hydroxymethyl)oxane-2,3,4,5-tetrol |
1 |
3 |
| NPC34764 |
1-Methyl-4-Prop-1-En-2-Ylcyclohexene |
1-methyl-4-prop-1-en-2-ylcyclohexene |
70 |
76 |
| NPC290333 |
RHULHUMGLDCWCP-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC92592 |
NDFKTBCGKNOHPJ-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC132307 |
D-Valine |
(2R)-2-azaniumyl-3-methylbutanoate |
7 |
17 |
| NPC307027 |
2-Oxoisovalerate |
3-methyl-2-oxobutanoic acid |
4 |
5 |
| NPC165122 |
Glycolic Acid |
2-hydroxyacetic acid |
4 |
6 |
| NPC162282 |
CKLJMWTZIZZHCS-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC61477 |
Catechin |
2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol |
54 |
129 |
| NPC216127 |
HMSWAIKSFDFLKN-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC29883 |
Paraben |
4-oxoniobenzoate |
78 |
176 |
| NPC208793 |
Aspartic Acid |
(2S)-2-aminobutanedioic acid |
42 |
70 |
| NPC18226 |
YXFDTUKUWNQPFV-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC2724 |
Alcohol |
ethanol |
27 |
1942 |
| NPC8368 |
Butyl Formate |
butyl formate |
1 |
2 |
| NPC12987 |
4-[(Z)-2-(3-Methoxyphenyl)Ethenyl]Phenol |
4-[(Z)-2-(3-methoxyphenyl)ethenyl]phenol |
65 |
76 |
| NPC191084 |
(3S)-3-Hydroxybutanoic Acid |
(3S)-3-hydroxybutanoic acid |
7 |
9 |
| NPC249126 |
AXFYFNCPONWUHW-UHFFFAOYSA-N |
n.a. |
1 |
2 |
| NPC84568 |
1,8-Dihydroxy-3-(Hydroxymethyl)-10-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]-10H-Anthracen-9-One |
1,8-dihydroxy-3-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one |
62 |
120 |
| NPC215862 |
QXKAIJAYHKCRRA-BXXZVTAOSA-N |
n.a. |
0 |
0 |
| NPC87299 |
D-1-Phenylethyl |
(1R)-1-phenylethanol |
1 |
3 |
| NPC258690 |
(2S,3S,4S,5R)-3,4,5,6-Tetrahydroxyoxane-2-Carboxylic Acid |
(2S,3S,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid |
2 |
2 |
| NPC15658 |
(-)-Catechin |
(2S,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol |
19 |
44 |
| NPC167976 |
CWVRJTMFETXNAD-XYXZIBEBSA-N |
n.a. |
0 |
0 |
| NPC211453 |
Butanone |
butan-2-one |
6 |
18 |
| NPC54264 |
DSSYKIVIOFKYAU-MHPPCMCBSA-N |
n.a. |
1 |
2 |
| NPC76145 |
Limonene |
(4R)-1-methyl-4-prop-1-en-2-ylcyclohexene |
43 |
225 |
| NPC119090 |
PCMORTLOPMLEFB-ARJAWSKDSA-N |
n.a. |
0 |
0 |
| NPC66624 |
Heptan-2-One |
heptan-2-one |
4 |
9 |
| NPC179831 |
Octanal |
octanal |
3 |
15 |
| NPC61398 |
Nataloe-Emodin |
1,2,8-trihydroxy-6-methylanthracene-9,10-dione |
12 |
13 |
| NPC109034 |
2-Methyl-(E)-2-Butenal |
(E)-2-methylbut-2-enal |
4 |
6 |
| NPC139029 |
(E)-Hexadec-9-Enoic Acid |
(E)-hexadec-9-enoic acid |
2 |
17 |
| NPC273930 |
NYHNVHGFPZAZGA-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC272614 |
L-Alanine |
(2S)-2-aminopropanoic acid |
14 |
22 |
| NPC95834 |
OTTXIFWBPRRYOG-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC206800 |
Cinnamic Acid |
(E)-3-phenylprop-2-enoic acid |
72 |
183 |
| NPC65611 |
HNVRRHSXBLFLIG-UHFFFAOYSA-N |
n.a. |
4 |
4 |
| NPC177988 |
FXPHBDIUPMICSK-YRNVUSSQSA-N |
n.a. |
0 |
0 |
| NPC24751 |
Cadaverine Tartrate |
2,3-dihydroxybutanedioic acid |
1 |
2 |
| NPC310820 |
MBDOYVRWFFCFHM-PLNGDYQASA-N |
n.a. |
0 |
0 |
| NPC302159 |
2-Picolinic Acid |
pyridine-2-carboxylic acid |
89 |
122 |
| NPC38371 |
HDIOAZQFHQKMAI-IPZRHRPYSA-N |
n.a. |
0 |
0 |
| NPC157340 |
Glycerin |
propane-1,2,3-triol |
14 |
26 |
| NPC148450 |
OVWYEQOVUDKZNU-UHFFFAOYSA-N |
n.a. |
1 |
1 |
| NPC307594 |
Methyl Isobutyl Ketone |
4-methylpentan-2-one |
7 |
8 |
| NPC60523 |
LUNCCTMWZWBSKQ-QHFAZAOBSA-N |
n.a. |
0 |
0 |
| NPC8236 |
FUYHDFCORAHYRE-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC21290 |
Alanine |
2-aminopropanoic acid |
19 |
30 |
| NPC279895 |
1-Heptanol |
heptan-1-ol |
11 |
27 |
| NPC276449 |
BYGQBDHUGHBGMD-YFKPBYRVSA-N |
n.a. |
0 |
0 |
| NPC139866 |
OWGCMMINSKNONQ-IWTSKDHTSA-N |
n.a. |
0 |
0 |
| NPC24223 |
OTTXIFWBPRRYOG-SCSAIBSYSA-N |
n.a. |
0 |
0 |
| NPC294902 |
Caffeic Acid |
(E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid |
219 |
596 |
| NPC241721 |
BSAIUMLZVGUGKX-FPLPWBNLSA-N |
n.a. |
0 |
0 |
| NPC185768 |
Pentane-2,4-Dione |
pentane-2,4-dione |
16 |
16 |
| NPC230301 |
Beta-Sitosterol |
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
107 |
201 |
| NPC7208 |
QNAYBMKLOCPYGJ-AZXPZELESA-N |
n.a. |
0 |
0 |
| NPC150450 |
WXUAQHNMJWJLTG-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC260837 |
2,3-Dihydroxybenzoic Acid |
2,3-dihydroxybenzoic acid |
23 |
29 |
| NPC146316 |
2-Methylfuran |
2-methylfuran |
4 |
5 |
| NPC19047 |
XEZVDURJDFGERA-UHFFFAOYSA-N |
n.a. |
1 |
1 |
| NPC245561 |
Hydroxyphenyl Propionic Acid |
3-(4-hydroxyphenyl)propanoic acid |
9 |
9 |
| NPC4962 |
2-Decanone |
decan-2-one |
10 |
13 |
| NPC52607 |
QZZGJDVWLFXDLK-MCHSYIMZSA-N |
n.a. |
0 |
0 |
| NPC103326 |
L-1-Phenylethyl |
(1S)-1-phenylethanol |
1 |
3 |
| NPC286485 |
ALRHLSYJTWAHJZ-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC150219 |
PUPZLCDOIYMWBV-SCSAIBSYSA-N |
n.a. |
0 |
0 |
| NPC213935 |
CZMRCDWAGMRECN-MPZPMKCMSA-N |
n.a. |
0 |
0 |
| NPC168052 |
3-Hydroxybutanoate |
3-hydroxybutanoic acid |
10 |
16 |
| NPC87529 |
2-Methylpropane-1,3-Diol |
2-methylpropane-1,3-diol |
1 |
4 |
| NPC288089 |
Rhein |
4,5-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid |
105 |
250 |
| NPC110899 |
Syringic Acid |
4-hydroxy-3,5-dimethoxybenzoic acid |
33 |
50 |
| NPC288078 |
WRLXHKDQSQMWSH-ZTUNSOAWSA-N |
n.a. |
0 |
0 |
| NPC223522 |
WRQPROLXESIJKE-CRZBQJGTSA-N |
n.a. |
0 |
0 |
| NPC255011 |
AVKZBTISTJWNNL-MKNNQNITSA-N |
n.a. |
0 |
0 |
| NPC270088 |
(2S,3R,4R)-2,3,4,5-Tetrahydroxypentanal |
(2S,3R,4R)-2,3,4,5-tetrahydroxypentanal |
1 |
2 |
| NPC75204 |
(E)-Hex-2-Enal |
(E)-hex-2-enal |
11 |
77 |
| NPC3357 |
BJEPYKJPYRNKOW-REOHCLBHSA-N |
n.a. |
1 |
1 |
| NPC113733 |
Stigmasterol |
(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
37 |
91 |
| NPC134252 |
(3R,4S,5S)-Oxane-2,3,4,5-Tetrol |
(3R,4S,5S)-oxane-2,3,4,5-tetrol |
3 |
5 |
| NPC103614 |
QACRJXSXSVUOFZ-HINKZNOMSA-N |
n.a. |
0 |
0 |
| NPC253810 |
3-Hydroxypicolinic Acid |
3-hydroxypyridine-2-carboxylic acid |
11 |
11 |
| NPC163556 |
Octanol |
octan-1-ol |
20 |
36 |
| NPC64434 |
SGNBVLSWZMBQTH-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC301743 |
AEMOLEFTQBMNLQ-QIUUJYRFSA-N |
n.a. |
4 |
14 |
| NPC32977 |
Cis-P-Coumaric Acid |
(Z)-3-(4-hydroxyphenyl)prop-2-enoic acid |
2 |
2 |
| NPC134135 |
OLSDAJRAVOVKLG-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC68889 |
Linalool (+) |
(3R)-3,7-dimethylocta-1,6-dien-3-ol |
5 |
6 |
| NPC275457 |
HKIKAXXIWJHWLY-ZIIYPAMZSA-N |
n.a. |
0 |
0 |
| NPC156654 |
Protocatechuic Acid |
3,4-dihydroxybenzoic acid |
81 |
181 |
| NPC164706 |
Isoferulic Acid |
(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic acid |
16 |
28 |
| NPC256853 |
Methanesulfonylmethane |
methylsulfonylmethane |
13 |
23 |
| NPC71460 |
(3S,5S,10S,13R,17R)-17-((R)-1,5-Dimethyl-Hexyl)-10,13-Dimethyl-Hexadecahydro-Cyclopenta[A]Phenanthren-3-Ol |
(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol |
7 |
7 |
| NPC133819 |
Isobutyraldehyde |
2-methylpropanal |
4 |
12 |
| NPC8466 |
Crotonaldehyde |
(E)-but-2-enal |
2 |
2 |
| NPC119107 |
CIWBSHSKHKDKBQ-DOAHDZERSA-N |
n.a. |
0 |
0 |
| NPC204932 |
Catechol |
benzene-1,2-diol |
116 |
551 |
| NPC171280 |
WBYWAXJHAXSJNI-SREVYHEPSA-N |
n.a. |
0 |
0 |
| NPC2785 |
Acetophenone |
1-phenylethanone |
15 |
51 |
| NPC293014 |
KJMBBHZOLRRVMV-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC83111 |
1H-Indole-5-Carboxylic Acid |
1H-indole-5-carboxylic acid |
2 |
3 |
| NPC2518 |
4-Methoxycinnamic Acid |
(E)-3-(4-methoxyphenyl)prop-2-enoic acid |
27 |
48 |
| NPC307739 |
D-Lactic Acid |
(2R)-2-hydroxypropanoic acid |
10 |
29 |
| NPC88887 |
Butane-1,3-Diol |
butane-1,3-diol |
2 |
9 |
| NPC253423 |
4-Methylbenzoic Acid |
4-methylbenzoic acid |
12 |
30 |
| NPC294085 |
Undecanedioic Acid |
undecanedioic acid |
2 |
7 |
| NPC26329 |
BTANRVKWQNVYAZ-BYPYZUCNSA-N |
n.a. |
0 |
0 |
| NPC286233 |
Pyruvate |
2-oxopropanoic acid |
15 |
31 |
| NPC55484 |
OWBTYPJTUOEWEK-IMJSIDKUSA-N |
n.a. |
0 |
0 |
| NPC78500 |
Benzaldehyde |
benzaldehyde |
26 |
62 |
| NPC22715 |
HDIOAZQFHQKMAI-XEFJUWELSA-N |
n.a. |
0 |
0 |
| NPC111888 |
Vanillic Acid |
4-hydroxy-3-methoxybenzoic acid |
45 |
104 |
| NPC235797 |
Acrolein |
prop-2-enal |
14 |
118 |
| NPC44671 |
USMNOWBWPHYOEA-OFQRNFBNSA-N |
n.a. |
0 |
0 |
| NPC88566 |
P-Cymene |
1-methyl-4-propan-2-ylbenzene |
12 |
33 |
| NPC154683 |
Madagascin |
1,8-dihydroxy-3-methyl-6-(3-methylbut-2-enoxy)anthracene-9,10-dione |
5 |
8 |
| NPC236709 |
Succinic Acid |
butanedioic acid |
18 |
45 |
| NPC308469 |
ZOCHHNOQQHDWHG-ZCFIWIBFSA-N |
n.a. |
0 |
0 |
| NPC180871 |
Linalool |
3,7-dimethylocta-1,6-dien-3-ol |
53 |
128 |
| NPC125144 |
Syn-Benzaldoxime |
(NZ)-N-benzylidenehydroxylamine |
2 |
6 |
| NPC72722 |
2-Dodecyl-3-Methylbutanedioic Acid |
2-dodecyl-3-methylbutanedioic acid |
5 |
5 |
| NPC127343 |
Phenyl Propionic Acid |
3-phenylpropanoic acid |
9 |
32 |
| NPC44751 |
DSSYKIVIOFKYAU-OMNKOJBGSA-N |
n.a. |
0 |
0 |
| NPC43571 |
GJWNAMOGOKAELX-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC97444 |
Tartrate |
(2R,3R)-2,3-dihydroxybutanedioic acid |
7 |
13 |
| NPC126925 |
Valine |
(2S)-2-azaniumyl-3-methylbutanoate |
21 |
30 |
| NPC23508 |
Ethyl Acetate |
ethyl acetate |
19 |
44 |
| NPC36108 |
Isoeugenol |
2-methoxy-4-[(E)-prop-1-enyl]phenol |
20 |
23 |
| NPC246679 |
O-Coumaric Acid |
(E)-3-(2-hydroxyphenyl)prop-2-enoic acid |
38 |
60 |
| NPC159967 |
YXFDTUKUWNQPFV-QMMMGPOBSA-N |
n.a. |
0 |
0 |
| NPC287331 |
Eucalyptol |
2,2,4-trimethyl-3-oxabicyclo[2.2.2]octane |
126 |
369 |
| NPC171188 |
Butanedione |
butane-2,3-dione |
19 |
33 |
| NPC76217 |
Lactic Acid |
2-hydroxypropanoic acid |
7 |
26 |
| NPC122922 |
OUGNWRCWQLUXHX-SSJBJWSWSA-N |
n.a. |
0 |
0 |
| NPC62765 |
Benzoic Acid |
hydron;benzoate |
53 |
340 |
| NPC31516 |
OLSDAJRAVOVKLG-ZETCQYMHSA-N |
n.a. |
0 |
0 |
| NPC59669 |
INKQLYSQWHBEGS-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC203052 |
UMEJBWOWZDRULR-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC289974 |
3-Methylbutanal |
3-methylbutanal |
2 |
4 |
| NPC187796 |
USMNOWBWPHYOEA-WEDXCCLWSA-N |
n.a. |
0 |
0 |
| NPC300326 |
Sinapinate |
(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid |
25 |
59 |
| NPC117411 |
Formic Acid Methyl Ester |
methyl formate |
3 |
11 |
| NPC232554 |
Hexan-3-Ol |
hexan-3-ol |
2 |
2 |
| NPC86634 |
QACRJXSXSVUOFZ-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC233231 |
2-Methyloxolan-3-One |
2-methyloxolan-3-one |
2 |
2 |
| NPC285322 |
D-Aspartate |
(2R)-2-aminobutanedioic acid |
13 |
17 |
| NPC19044 |
(2R)-2-Hydroxybutanedioic Acid |
(2R)-2-hydroxybutanedioic acid |
4 |
4 |
| NPC209970 |
Stearic Acid |
octadecanoic acid |
31 |
69 |
| NPC65651 |
WXUAQHNMJWJLTG-GSVOUGTGSA-N |
n.a. |
0 |
0 |
| NPC40249 |
(-)-Camphor |
(1S,4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one |
6 |
234 |
| NPC279300 |
(E)-2-Heptenal |
(E)-hept-2-enal |
15 |
26 |
| NPC197783 |
4-Ethylphenol |
4-ethylphenol |
13 |
36 |
| NPC175852 |
(2S)-2-Hydroxy-2-Phenylacetic Acid |
(2S)-2-hydroxy-2-phenylacetic acid |
11 |
16 |
| NPC300684 |
(10S)-1,8-Dihydroxy-3-(Hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]-10H-Anthracen-9-One |
(10S)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-10H-anthracen-9-one |
4 |
14 |
| NPC170523 |
AFHJQYHRLPMKHU-HNQWYIDQSA-N |
n.a. |
0 |
0 |
| NPC275462 |
1-Hexanol |
hexan-1-ol |
22 |
74 |
| NPC59666 |
BSYVTEYKTMYBMK-YFKPBYRVSA-N |
n.a. |
0 |
0 |
| NPC81010 |
Coumaric Acid |
(E)-3-(4-hydroxyphenyl)prop-2-enoic acid |
85 |
213 |
| NPC250870 |
(R)-3-Hydroxybutanoate |
(3R)-3-hydroxybutanoic acid |
10 |
10 |
| NPC174304 |
Glutathione |
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid |
20 |
86 |
| NPC116775 |
Kaempferol |
3,5,7-trihydroxy-2-(4-hydroxyphenyl)chromen-4-one |
208 |
612 |
| NPC208021 |
Propylformate |
propyl formate |
1 |
2 |
| NPC290613 |
KZJWDPNRJALLNS-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC64022 |
UIERETOOQGIECD-ONEGZZNKSA-N |
n.a. |
1 |
1 |
| NPC299484 |
Butanol |
butan-2-ol |
7 |
19 |
| NPC183985 |
HKKOALUTOMGGMT-UUBBYFPSSA-N |
n.a. |
0 |
0 |
| NPC88839 |
Isobutanol |
2-methylpropan-1-ol |
9 |
25 |
| NPC40197 |
FAMJUFMHYAFYNU-JTQLQIEISA-N |
n.a. |
0 |
0 |
| NPC176740 |
Rutin |
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one |
103 |
333 |
| NPC216630 |
Palmitic Acid |
hexadecanoic acid |
59 |
236 |
| NPC37479 |
Butanal |
butanal |
6 |
14 |
| NPC137050 |
Acetic Acid Methyl Ester |
methyl acetate |
4 |
15 |
| NPC29 |
KZJWDPNRJALLNS-GDQWMHGZSA-N |
n.a. |
0 |
0 |
| NPC258605 |
YGSPWCVTJRFZEL-UHFFFAOYSA-M |
n.a. |
0 |
0 |
| NPC149193 |
FERIUCNNQQJTOY-UHFFFAOYSA-M |
n.a. |
0 |
0 |
| NPC88582 |
HKKOALUTOMGGMT-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC291158 |
Cetostearyl Alcohol |
octadecan-1-ol |
12 |
21 |
| NPC256186 |
3-Methylbutanol |
3-methylbutan-1-ol |
4 |
5 |
| NPC304309 |
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-Dimethylheptan-2-Yl]-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol |
(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
2 |
9 |
| NPC53139 |
Aloinoside B |
(10R)-1,8-dihydroxy-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]-10H-anthracen-9-one |
1 |
3 |
| NPC294548 |
Linolenic Acid |
(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid |
78 |
247 |
| NPC311987 |
Furan-2-Carboxylic Acid |
furan-2-carboxylic acid |
2 |
6 |
| NPC116709 |
D-Alanine |
(2R)-2-azaniumylpropanoate |
13 |
22 |
| NPC291502 |
Oxane-2,3,4,5-Tetrol |
oxane-2,3,4,5-tetrol |
5 |
5 |
| NPC11368 |
QPRQEDXDYOZYLA-RXMQYKEDSA-N |
n.a. |
0 |
0 |
| NPC197376 |
RWQKHEORZBHNRI-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC208151 |
USMNOWBWPHYOEA-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC66655 |
Benzyl Alcohol |
phenylmethanol |
20 |
50 |
| NPC16823 |
HOGWBMWOBRRKCD-YPKPFQOOSA-N |
n.a. |
0 |
0 |
| NPC232231 |
BUPDVJFRVYWYEV-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC70744 |
Ferulic Acid |
(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid |
146 |
590 |
| NPC165967 |
QZZGJDVWLFXDLK-UHFFFAOYSA-N |
n.a. |
1 |
1 |
| NPC163260 |
HKKOALUTOMGGMT-DZJZYXOHSA-N |
n.a. |
0 |
0 |
| NPC50898 |
Apigenin |
5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one |
399 |
1052 |
| NPC127074 |
Arabitol(D) |
(2R,4R)-pentane-1,2,3,4,5-pentol |
3 |
3 |
| NPC16728 |
CZMRCDWAGMRECN-GCGUNJLOSA-N |
n.a. |
0 |
0 |
| NPC269442 |
ACWQBUSCFPJUPN-HYXAFXHYSA-N |
n.a. |
0 |
0 |
| NPC5953 |
BTANRVKWQNVYAZ-SCSAIBSYSA-N |
n.a. |
0 |
0 |
| NPC113832 |
WRQPROLXESIJKE-YHFJPUIQSA-N |
n.a. |
0 |
0 |
| NPC85185 |
MLUCVPSAIODCQM-IHWYPQMZSA-N |
n.a. |
0 |
0 |
| NPC230995 |
AFENDNXGAFYKQO-GSVOUGTGSA-N |
n.a. |
0 |
0 |
| NPC139546 |
CDOSHBSSFJOMGT-SNVBAGLBSA-N |
n.a. |
7 |
7 |
| NPC122086 |
XEKOWRVHYACXOJ-AZXPZELESA-N |
n.a. |
0 |
0 |
| NPC137153 |
SOANVOIJXGSERP-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC282923 |
Chrysophanol |
1,8-dihydroxy-3-methylanthracene-9,10-dione |
86 |
146 |
| NPC30760 |
ZOCHHNOQQHDWHG-LURJTMIESA-N |
n.a. |
0 |
0 |
| NPC229468 |
IZBGWXJOIXZDBF-WLFSTHIVSA-N |
n.a. |
0 |
0 |
| NPC59581 |
Hexanal |
hexanal |
25 |
54 |
| NPC95965 |
Phenylpyruvate |
2-oxo-3-phenylpropanoic acid |
6 |
13 |
| NPC80982 |
FAMJUFMHYAFYNU-SNVBAGLBSA-N |
n.a. |
0 |
0 |
| NPC160332 |
OLSDAJRAVOVKLG-SSDOTTSWSA-N |
n.a. |
0 |
0 |
| NPC14330 |
Hypoxanthine |
3,7-dihydropurin-6-one |
18 |
49 |
| NPC129039 |
SWMFAAPTSMVULA-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC302857 |
Chlorogenic Acid |
(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid |
68 |
174 |
| NPC155505 |
WXUAQHNMJWJLTG-VKHMYHEASA-N |
n.a. |
0 |
0 |
| NPC4665 |
3,4-Dihydroxyphenylacetic Acid |
2-(3,4-dihydroxyphenyl)acetic acid |
50 |
89 |
| NPC163835 |
UZTAUYULOKFHMC-UHFFFAOYSA-N |
n.a. |
0 |
0 |
| NPC108218 |
Phenylethyl Alcohol |
2-phenylethanol |
14 |
32 |
| NPC171736 |
Behenic Acid |
docosanoic acid |
13 |
17 |
| NPC140389 |
Butane-2,3-Diol |
butane-2,3-diol |
2 |
7 |
| NPC39289 |
JRHWHSJDIILJAT-BYPYZUCNSA-N |
n.a. |
0 |
0 |
| NPC214610 |
Azelaic Acid |
hydron;nonanedioate |
25 |
82 |
Organism Name: Aloe spicata