> Alkaloids and derivatives / Harmala alkaloids
|
Begonanline
|
21577086 |
Click to see
COC(=O)C1=NC=CC2=C1NC3=C2C=C(C=C3)O
|
242.23 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids
|
Benzoic Acid
|
243 |
Click to see
C1=CC=C(C=C1)C(=O)O
|
122.12 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
|
3,4-Dihydroxybenzoic acid
|
72 |
Click to see
C1=CC(=C(C=C1C(=O)O)O)O
|
154.12 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
4-Hydroxybenzoic acid
|
135 |
Click to see
C1=CC(=CC=C1C(=O)O)O
|
138.12 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
|
3,4,5-Trimethoxybenzoic Acid
|
8357 |
Click to see
COC1=CC(=CC(=C1OC)OC)C(=O)O
|
212.20 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
|
Methyl vanillate
|
19844 |
Click to see
COC1=C(C=CC(=C1)C(=O)OC)O
|
182.17 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Vanillic Acid
|
8468 |
Click to see
COC1=C(C=CC(=C1)C(=O)O)O
|
168.15 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters
|
Methylparaben
|
7456 |
Click to see
COC(=O)C1=CC=C(C=C1)O
|
152.15 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
Protocatechuic acid, methyl ester
|
287064 |
Click to see
COC(=O)C1=CC(=C(C=C1)O)O
|
168.15 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Benzenoids / Benzene and substituted derivatives / Phenethylamines / Amphetamines and derivatives
|
N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
|
852848 |
Click to see
C1=CC=C(C=C1)CC(CO)NC(=O)C2=CC=CC=C2
|
255.31 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
N-Benzoyl-L-phenylalaninol
|
100005 |
Click to see
C1=CC=C(C=C1)CC(CO)NC(=O)C2=CC=CC=C2
|
255.31 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Benzenoids / Phenols / Benzenetriols and derivatives / Hydroxyquinols and derivatives
|
1,2,4-Benzenetriol
|
10787 |
Click to see
C1=CC(=C(C=C1O)O)O
|
126.11 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Benzenoids / Phenols / Methoxyphenols
|
Vanillin
|
1183 |
Click to see
COC1=C(C=CC(=C1)C=O)O
|
152.15 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Lignans, neolignans and related compounds
|
[(3S)-1,5-diphenylhex-5-en-3-yl]benzene
|
45356241 |
Click to see
C=C(CC(CCC1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3
|
312.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
2,4,6-Triphenyl-1-hexene
|
177033 |
Click to see
C=C(CC(CCC1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3
|
312.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
|
9-Hydroxylinoleic acid
|
21158590 |
Click to see
CCCCCC=CCC=C(CCCCCCCC(=O)O)O
|
296.40 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
9-Hydroxyoctadeca-9,12-dienoic acid
|
73226949 |
Click to see
CCCCCC=CCC=C(CCCCCCCC(=O)O)O
|
296.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 1-monoacylglycerols
|
[(2R)-2,3-dihydroxypropyl] tetracosanoate
|
163004763 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)O
|
442.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
2,3-Dihydroxypropyl tetracosanoate
|
14542801 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)O
|
442.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls
|
Lutein
|
5281243 |
Click to see
CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CC(CC2(C)C)O)C)C)C
|
568.90 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
3-Hydroxyolean-12-en-28-oic acid
|
619166 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
4,10-Dihydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
|
5257562 |
Click to see
CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5O)(C)C(=O)O)C)C)C)C
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
Oleanolic Acid
|
10494 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
Triptotriterpenic acid A
|
21594203 |
Click to see
CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5O)(C)C(=O)O)C)C)C)C
|
472.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Lipids and lipid-like molecules / Sphingolipids / Ceramides / Phytoceramides
|
2-(2-Hydroxytricosanoylamino)-1,3,4-hexadecanetriol
|
85270419 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC(C(=O)NC(CO)C(C(CCCCCCCCCCCC)O)O)O
|
642.00 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cucurbitacins
|
(2S,3R,8S,9R,10R,13R,14S,16R,17R)-17-[(E,2R)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one
|
68103154 |
Click to see
CC1(C(C(CC2C1=CCC3C2(C(=O)CC4(C3(CC(C4C(C)(C(=O)C=CC(C)(C)O)O)O)C)C)C)O)O)C
|
518.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
[6-(2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate
|
2885 |
Click to see
CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O
|
558.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
[6-(2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate
|
2887 |
Click to see
CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)O)C)C)C)O)O
|
556.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
[6-(2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxoheptan-2-yl] acetate
|
73802899 |
Click to see
CC(=O)OC(C)(C)CCC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)O)C)C)C)O)O
|
558.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
17-(1,5-Dihydroxy-1,5-dimethyl-2-oxo-3-hexenyl)-2,16-dihydroxy-4,4,9,14-tetramethylestra-1,5-diene-3,11-dione
|
2888 |
Click to see
CC1(C2=CCC3C4(CC(C(C4(CC(=O)C3(C2C=C(C1=O)O)C)C)C(C)(C(=O)C=CC(C)(C)O)O)O)C)C
|
514.60 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
17-(2,6-Dihydroxy-6-methyl-3-oxohept-4-en-2-yl)-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one
|
429242 |
Click to see
CC1(C(C(CC2C1=CCC3C2(C(=O)CC4(C3(CC(C4C(C)(C(=O)C=CC(C)(C)O)O)O)C)C)C)O)O)C
|
518.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
17-(2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione
|
4482417 |
Click to see
CC1(C2=CCC3C4(CC(C(C4(CC(=O)C3(C2C=C(C1=O)O)C)C)C(C)(C(=O)CCC(C)(C)O)O)O)C)C
|
516.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
23,24-dihydrocucurbitacin E
|
21577087 |
Click to see
CC(=O)OC(C)(C)CCC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)O)C)C)C)O)O
|
558.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Cucurbitacin B
|
5281316 |
Click to see
CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O
|
558.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Cucurbitacin B, dihydro-
|
588303 |
Click to see
CC(=O)OC(C)(C)CCC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O
|
560.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Cucurbitacin E
|
5281319 |
Click to see
CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)O)C)C)C)O)O
|
556.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
Cucurbitacin F
|
5281320 |
Click to see
CC1(C(C(CC2C1=CCC3C2(C(=O)CC4(C3(CC(C4C(C)(C(=O)C=CC(C)(C)O)O)O)C)C)C)O)O)C
|
518.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Cucurbitacin I
|
5281321 |
Click to see
CC1(C2=CCC3C4(CC(C(C4(CC(=O)C3(C2C=C(C1=O)O)C)C)C(C)(C(=O)C=CC(C)(C)O)O)O)C)C
|
514.60 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
Cucurbitacin L
|
441820 |
Click to see
CC1(C2=CCC3C4(CC(C(C4(CC(=O)C3(C2C=C(C1=O)O)C)C)C(C)(C(=O)CCC(C)(C)O)O)O)C)C
|
516.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
Dihydrocucurbitacin B
|
267250 |
Click to see
CC(=O)OC(C)(C)CCC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3CC(C(=O)C4(C)C)O)C)C)C)O)O
|
560.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
(2R,3R,4S,5S,6S)-2-[[(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-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
154496016 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2S,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
|
12314479 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
17-(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
|
86821 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
24-Ethylcholest-5-en-3beta-ol
|
22012 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
Beta-Sitosterol
|
222284 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
beta-Sitosterol 3-O-beta-D-galactopyranoside
|
296119 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
Sitogluside
|
5742590 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
Stigmast-4-en-3-one
|
5484202 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
Stigmast-4-en-3-one, (24S)-
|
579897 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
Stigmasterol
|
5280794 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives
|
(2-Benzamido-3-phenylpropyl) 2-benzamido-3-phenylpropanoate
|
328238 |
Click to see
C1=CC=C(C=C1)CC(COC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4
|
506.60 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
[(2R)-2-benzamido-3-phenylpropyl] (2R)-2-benzamido-3-phenylpropanoate
|
57401749 |
Click to see
C1=CC=C(C=C1)CC(COC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4
|
506.60 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
3-[[1-(4-Aminobutylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylic acid
|
19423296 |
Click to see
C1=CC=C(C=C1)CC(C(=O)NCCCCN)NC(=O)C2C(O2)C(=O)O
|
349.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
Asperphenamate
|
173952 |
Click to see
C1=CC=C(C=C1)CC(COC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4
|
506.60 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols
|
(2R)-2-hydroxy-N-[(2R,3S,4R)-1,3,4-trihydroxyhexadecan-2-yl]tricosanamide
|
162929631 |
Click to see
CCCCCCCCCCCCCCCCCCCCCC(C(=O)NC(CO)C(C(CCCCCCCCCCCC)O)O)O
|
642.00 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives
|
(S)-Methyl 2,3-dihydroxypropanoate
|
11083880 |
Click to see
COC(=O)C(CO)O
|
120.10 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Methyl 2,3-dihydroxypropanoate
|
140003 |
Click to see
COC(=O)C(CO)O
|
120.10 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
|
4-Hydroxybenzaldehyde
|
126 |
Click to see
C1=CC(=CC=C1C=O)O
|
122.12 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Organic oxygen compounds / Organooxygen compounds / Ethers / Acetals / Ketals
|
(S)-methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate
|
853165 |
Click to see
CC1(OCC(O1)C(=O)OC)C
|
160.17 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Organoheterocyclic compounds / Benzodioxoles
|
N-(2-phenylethyl)-1,3-benzodioxole-5-carboxamide
|
669595 |
Click to see
C1OC2=C(O1)C=C(C=C2)C(=O)NCCC3=CC=CC=C3
|
269.29 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
Piperonylic acid
|
7196 |
Click to see
C1OC2=C(O1)C=C(C=C2)C(=O)O
|
166.13 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Chromones
|
5,7-Dihydroxychromone
|
5281343 |
Click to see
C1=COC2=CC(=CC(=C2C1=O)O)O
|
178.14 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Pyrimidones
|
Uracil
|
1174 |
Click to see
C1=CNC(=O)NC1=O
|
112.09 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Organoheterocyclic compounds / Indoles and derivatives / Indolecarboxylic acids and derivatives
|
Indole-3-carboxylic acid
|
69867 |
Click to see
C1=CC=C2C(=C1)C(=CN2)C(=O)O
|
161.16 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Organoheterocyclic compounds / Indoles and derivatives / Indoles
|
Indole-3-carboxaldehyde
|
10256 |
Click to see
C1=CC=C2C(=C1)C(=CN2)C=O
|
145.16 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxylic acids
|
Nicotinic acid
|
938 |
Click to see
C1=CC(=CN=C1)C(=O)O
|
123.11 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
[(12S)-12-methyldocosyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
163190933 |
Click to see
CCCCCCCCCCC(C)CCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
516.80 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
12-Methyldocosyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
|
163017166 |
Click to see
CCCCCCCCCCC(C)CCCCCCCCCCCOC(=O)C=CC1=CC(=C(C=C1)O)OC
|
516.80 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
|
3,4-Dihydroxy cinnamic acid
|
2518 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
4-Hydroxycinnamic acid
|
322 |
Click to see
C1=CC(=CC=C1C=CC(=O)O)O
|
164.16 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
Caffeic Acid
|
689043 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
Ferulic acid
|
445858 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)O)O
|
194.18 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
p-Coumaric acid
|
637542 |
Click to see
C1=CC(=CC=C1C=CC(=O)O)O
|
164.16 |
unknown |
https://doi.org/10.1002/CHIN.200434239 https://doi.org/10.1248/CPB.52.345 |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
|
(-)-Catechin
|
73160 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol
|
1203 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
|
Vitexin
|
5280441 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O
|
432.40 |
unknown |
https://doi.org/10.1002/CHIN.200434239 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-8-O-glycosides
|
4',5,7-Trihydroxy-8-(beta-D-glucopyranosyloxy)flavone
|
6420079 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
6169038 |
Click to see
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflav-2-enes / Isoflavones
|
Daidzein
|
5281708 |
Click to see
C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
|
254.24 |
unknown |
https://doi.org/10.1248/CPB.52.345 https://doi.org/10.1002/CHIN.200434239 |
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid O-glycosides
|
Daidzin
|
107971 |
Click to see
C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O)O
|
416.40 |
unknown |
https://doi.org/10.1248/CPB.52.345 |
> Phenylpropanoids and polyketides / Linear 1,3-diarylpropanoids
|
2,4-Diphenyl-1-butene
|
519286 |
Click to see
C=C(CCC1=CC=CC=C1)C2=CC=CC=C2
|
208.30 |
unknown |
https://doi.org/10.1248/CPB.52.345 |