> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Phthalate esters / m-Phthalate esters
|
Neothamnolic acid
|
100997974 |
Click to see
CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C3=C2COC3=O)O)C)O)O)C(=O)O)OC
|
404.30 |
unknown |
https://doi.org/10.1271/BBB1961.40.353 |
> Lipids and lipid-like molecules / Fatty Acyls / Eicosanoids / Prostaglandins and related compounds
|
(8S,9S,10R,13S,14S,16S,17R)-17-[(1R)-1-[(4S,5R)-4,5-dimethyl-6-oxooxan-2-yl]-1-hydroxyethyl]-16-hydroxy-10-methyl-4,7,8,9,11,13,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,12-dione
|
10972523 |
Click to see
CC1CC(OC(=O)C1C)C(C)(C2C(CC3C2C(=O)CC4C3CC=C5C4(C(=O)C=CC5)C)O)O
|
456.60 |
unknown |
https://doi.org/10.1016/S0040-4039(01)81296-X |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
|
(2Z,8E)-2,8-Decadiene-4,6-diynoic acid methyl ester
|
91753646 |
Click to see
CC=CC#CC#CC=CC(=O)OC
|
174.20 |
unknown |
https://doi.org/10.1271/BBB1961.40.353 |
2-Decene-4,6-diynoic acid, methyl ester, (Z)-
|
643924 |
Click to see
CCCC#CC#CC=CC(=O)OC
|
176.21 |
unknown |
https://doi.org/10.1016/0031-9422(92)80433-F |
2-Decene-4,6,8-triynoic acid, methyl ester, (Z)-
|
5281309 |
Click to see
CC#CC#CC#CC=CC(=O)OC
|
172.18 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1271/BBB1961.40.353 https://doi.org/10.1248/CPB.38.3483 |
2,8-Decadiene-4,6-diynoic acid, methyl ester, (Z,Z)-
|
5319306 |
Click to see
CC=CC#CC#CC=CC(=O)OC
|
174.20 |
unknown |
https://doi.org/10.1271/BBB1961.40.353 https://doi.org/10.1016/0031-9422(92)80433-F https://doi.org/10.1080/00021369.1977.10862478 |
Dehydromatricaria ester
|
5281146 |
Click to see
CC#CC#CC#CC=CC(=O)OC
|
172.18 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Lachnophyllum ester
|
642290 |
Click to see
CCCC#CC#CC=CC(=O)OC
|
176.21 |
unknown |
https://doi.org/10.1271/BBB1961.40.353 |
Methyl 2-decene-4,6,8-triynoate
|
75958 |
Click to see
CC#CC#CC#CC=CC(=O)OC
|
172.18 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1248/CPB.38.3483 |
Methyl deca-2,8-dien-4,6-diynoate
|
185530 |
Click to see
CC=CC#CC#CC=CC(=O)OC
|
174.20 |
unknown |
https://doi.org/10.1080/00021369.1977.10862478 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
|
methyl (2Z,8Z)-10-[(Z)-2-methylbut-2-enoyl]oxydeca-2,8-dien-4,6-diynoate
|
6475133 |
Click to see
CC=C(C)C(=O)OCC=CC#CC#CC=CC(=O)OC
|
272.29 |
unknown |
https://doi.org/10.1271/BBB1961.40.353 |
Methyl 10-(2-methylbut-2-enoyloxy)deca-2,8-dien-4,6-diynoate
|
470964 |
Click to see
CC=C(C)C(=O)OCC=CC#CC#CC=CC(=O)OC
|
272.29 |
unknown |
https://doi.org/10.1271/BBB1961.40.353 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
methyl (E)-5-[(1S,2R,4aR,8aR)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoate
|
162917634 |
Click to see
CC(=CC(=O)OC)CCC1C2(CCCC(C2CCC1(C)O)(C)C)C
|
336.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl 5-(2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpent-2-enoate
|
72786075 |
Click to see
CC(=CC(=O)OC)CCC1C2(CCCC(C2CCC1(C)O)(C)C)C
|
336.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Colensane and clerodane diterpenoids
|
(4aS,5R,6S,8aS)-5-[(E)-4-carboxy-3-methylbut-3-enyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
|
101281358 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CCC=C2C(=O)O)C
|
334.40 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
(E)-5-[(1R,2S,3S,4aR,8aR)-3-acetyloxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
|
162921224 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)O)C)CCC=C2C)C)OC(=O)C
|
362.50 |
unknown |
https://doi.org/10.1016/S0040-4039(00)76420-3 |
(E)-5-[(1S,2R,4R,4aR,8aR)-1,2,4a,5-tetramethyl-4-[(E)-2-methylbut-2-enoyl]oxy-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
|
163100244 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC(=CC(=O)O)C)C
|
402.60 |
unknown |
https://doi.org/10.1246/NIKKASHI.1973.590 |
[(1R,3R,4S,4aR,8aR)-4-[(E)-5-methoxy-3-methyl-5-oxopent-3-enyl]-3,4,8,8a-tetramethyl-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] (4S,5S)-4,5-dimethyl-3,4-dihydropyrazole-5-carboxylate
|
162846721 |
Click to see
CC1CC(C2(C(C1(C)CCC(=CC(=O)OC)C)CCC=C2C)C)OC(=O)C3(C(CN=N3)C)C
|
458.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
[(1S,3R,4S,4aR,8aR)-4-[(E)-5-methoxy-3-methyl-5-oxopent-3-enyl]-3,4,8,8a-tetramethyl-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] (4S,5S)-4,5-dimethyl-3,4-dihydropyrazole-5-carboxylate
|
162846720 |
Click to see
CC1CC(C2(C(C1(C)CCC(=CC(=O)OC)C)CCC=C2C)C)OC(=O)C3(C(CN=N3)C)C
|
458.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
[4-(5-Methoxy-3-methyl-5-oxopent-3-enyl)-3,4,8,8a-tetramethyl-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] 4,5-dimethyl-3,4-dihydropyrazole-5-carboxylate
|
162846719 |
Click to see
CC1CC(C2(C(C1(C)CCC(=CC(=O)OC)C)CCC=C2C)C)OC(=O)C3(C(CN=N3)C)C
|
458.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
2-Oxo-kolavenic acid
|
13918477 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CC(=O)C=C2C)C
|
318.40 |
unknown |
https://doi.org/10.1177/1934578X1501000106 |
5-(1,2,4a,5-Tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-en-1-ol
|
73808214 |
Click to see
CC1CCC2(C(C1(C)CCC(=CCO)C)CCC=C2C)C
|
290.50 |
unknown |
https://doi.org/10.1246/BCSJ.42.812 https://doi.org/10.5650/JOS1996.48.139 |
5-(1,2,4a,5-Tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-enoic acid
|
73880585 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CCC=C2C)C
|
304.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1016/S0031-9422(00)83202-1 |
5-[1,2,4a,5-Tetramethyl-4-(2-methylbut-2-enoyloxy)-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
|
163100242 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC(=CC(=O)O)C)C
|
402.60 |
unknown |
https://doi.org/10.1246/NIKKASHI.1973.590 |
CID 11068459
|
11068459 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)O)C)CCC=C2C)C)OC(=O)C
|
362.50 |
unknown |
https://doi.org/10.1246/BCSJ.42.812 https://doi.org/10.1246/NIKKASHI.1973.590 https://doi.org/10.5650/JOS1996.48.139 |
Kolavenic acid
|
6441458 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CCC=C2C)C
|
304.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1177/1934578X1501000106 https://doi.org/10.1016/S0031-9422(00)83202-1 |
Kolavenol
|
6442554 |
Click to see
CC1CCC2(C(C1(C)CCC(=CCO)C)CCC=C2C)C
|
290.50 |
unknown |
https://doi.org/10.1246/BCSJ.42.812 https://doi.org/10.5650/JOS1996.48.139 |
methyl (E)-5-[(1R,2S,3R,4aR,6R,8aR)-3-acetyloxy-6-hydroxy-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylpent-2-enoate
|
101037223 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(C2=C)O)C)OC(=O)C
|
392.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1R,2S,3R,4aR,6S,8aR)-3-acetyloxy-6-hydroxy-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylpent-2-enoate
|
101036868 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(C2=C)O)C)OC(=O)C
|
392.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1R,2S,3R,4aR,7S,8aR)-3-acetyloxy-7-hydroxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
15484927 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C=C2C)O)C)OC(=O)C
|
392.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1R,2S,3R,4aR,8aR)-3-acetyloxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
14357371 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CCC=C2C)C)OC(=O)C
|
376.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1016/S0031-9422(00)83202-1 |
methyl (E)-5-[(1R,2S,3R,4aR,8aR)-3-acetyloxy-1,2,4a,5-tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpent-2-enoate
|
101036870 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=O)C=C2C)C)OC(=O)C
|
390.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1S,2R,4aR,6S,8aR)-6-hydroxy-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylpent-2-enoate
|
163034216 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(C2=C)O)C
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1S,2R,4aR,7R,8aR)-7-hydroxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
15484928 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C=C2C)O)C
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1S,2R,4aR,7S,8aR)-7-hydroxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
15484929 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C=C2C)O)C
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1S,2R,4aR,8aR)-1,2,4a-trimethyl-5-methylidene-6-oxo-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
101036871 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(=O)C2=C)C
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl]-3-methylpent-2-enoate
|
12096942 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=O)C=C2C)C
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1016/S0031-9422(00)83202-1 https://doi.org/10.1246/NIKKASHI.1972.963 |
methyl (E)-5-[(1S,2R,4R,4aR,8aR)-1,2,4a,5-tetramethyl-4-[(Z)-2-methylbut-2-enoyl]oxy-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
14357375 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC(=CC(=O)OC)C)C
|
416.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(1S,2R,4S,4aR,8aR)-1,2,4a,5-tetramethyl-4-[(E)-2-methylbut-2-enoyl]oxy-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
162993950 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC(=CC(=O)OC)C)C
|
416.60 |
unknown |
https://doi.org/10.1246/NIKKASHI.1972.963 |
methyl (E)-5-[(1S,2R,4S,4aR,8aR)-1,2,4a,5-tetramethyl-4-[(Z)-2-methylbut-2-enoyl]oxy-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
162993951 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC(=CC(=O)OC)C)C
|
416.60 |
unknown |
https://doi.org/10.1246/NIKKASHI.1972.963 |
Methyl 5-(1,2,4a-trimethyl-5-methylidene-6-oxo-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-enoate
|
162935193 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(=O)C2=C)C
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl 5-(1,2,4a,5-tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoate
|
75804691 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=O)C=C2C)C
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1016/S0031-9422(00)83202-1 https://doi.org/10.1246/NIKKASHI.1972.963 |
Methyl 5-(3-acetyloxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-enoate
|
163003860 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CCC=C2C)C)OC(=O)C
|
376.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1016/S0031-9422(00)83202-1 |
methyl 5-(3-acetyloxy-1,2,4a,5-tetramethyl-7-oxo-3,4,8,8a-tetrahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoate
|
162845258 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=O)C=C2C)C)OC(=O)C
|
390.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl 5-(3-acetyloxy-6-hydroxy-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoate
|
162875046 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(C2=C)O)C)OC(=O)C
|
392.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Methyl 5-(3-acetyloxy-7-hydroxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-enoate
|
163039169 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C=C2C)O)C)OC(=O)C
|
392.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl 5-(6-hydroxy-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl)-3-methylpent-2-enoate
|
163034215 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CCC(C2=C)O)C
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Methyl 5-(7-hydroxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-methylpent-2-enoate
|
163028761 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C=C2C)O)C
|
334.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Methyl 5-[1,2,4a,5-tetramethyl-4-(2-methylbut-2-enoyloxy)-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoate
|
162993949 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC(=CC(=O)OC)C)C
|
416.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 https://doi.org/10.1246/NIKKASHI.1972.963 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Iridoids and derivatives
|
(E)-5-[(3aR,4S,5R,7aR)-2-formyl-1,4,5,7a-tetramethyl-3a,5,6,7-tetrahydro-3H-inden-4-yl]-3-methylpent-2-enoic acid
|
101285195 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CC(=C2C)C=O)C
|
318.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 https://doi.org/10.1177/1934578X1501000106 |
5-(2-formyl-1,4,5,7a-tetramethyl-3a,5,6,7-tetrahydro-3H-inden-4-yl)-3-methylpent-2-enoic acid
|
163035499 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CC(=C2C)C=O)C
|
318.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
methyl (E)-5-[(1S,2S,3aR,4R,5S,6R,7aR)-2-acetyl-6-acetyloxy-1-hydroxy-1,4,5,7a-tetramethyl-2,3,3a,5,6,7-hexahydroinden-4-yl]-3-methylpent-2-enoate
|
101036867 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C2(C)O)C(=O)C)C)OC(=O)C
|
422.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(3aR,4R,5S,6R,7aR)-6-acetyloxy-2-formyl-1,4,5,7a-tetramethyl-3a,5,6,7-tetrahydro-3H-inden-4-yl]-3-methylpent-2-enoate
|
101036869 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=C2C)C=O)C)OC(=O)C
|
390.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl (E)-5-[(3aR,4S,5R,7aR)-2-formyl-1,4,5,7a-tetramethyl-3a,5,6,7-tetrahydro-3H-inden-4-yl]-3-methylpent-2-enoate
|
100980002 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=C2C)C=O)C
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Methyl 5-(2-acetyl-6-acetyloxy-1-hydroxy-1,4,5,7a-tetramethyl-2,3,3a,5,6,7-hexahydroinden-4-yl)-3-methylpent-2-enoate
|
162864592 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C2(C)O)C(=O)C)C)OC(=O)C
|
422.60 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl 5-(2-formyl-1,4,5,7a-tetramethyl-3a,5,6,7-tetrahydro-3H-inden-4-yl)-3-methylpent-2-enoate
|
162908186 |
Click to see
CC1CCC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=C2C)C=O)C
|
332.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Methyl 5-(6-acetyloxy-2-formyl-1-hydroxy-1,4,5,7a-tetramethyl-2,3,3a,5,6,7-hexahydroinden-4-yl)-3-methylpent-2-enoate
|
162943147 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(C2(C)O)C=O)C)OC(=O)C
|
408.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
methyl 5-(6-acetyloxy-2-formyl-1,4,5,7a-tetramethyl-3a,5,6,7-tetrahydro-3H-inden-4-yl)-3-methylpent-2-enoate
|
163042379 |
Click to see
CC1C(CC2(C(C1(C)CCC(=CC(=O)OC)C)CC(=C2C)C=O)C)OC(=O)C
|
390.50 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
|
(S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene
|
91723653 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1177/1934578X1501000106 |
4,10-Dimethylidene-7-(propan-2-yl)cyclodec-5-en-1-ol
|
71370041 |
Click to see
CC(C)C1CCC(=C)C(CCC(=C)C=C1)O
|
220.35 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
4(15),5,10(14)-Germacratrien-1-ol
|
13304977 |
Click to see
CC(C)C1CCC(=C)C(CCC(=C)C=C1)O
|
220.35 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
|
[(1aR,3aS,4R,5R,7R,7aS,7bS)-4,5,7a,7b-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-7-yl] acetate
|
163005054 |
Click to see
CC1CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCC4C2(O4)C)C)OC(=O)C
|
376.50 |
unknown |
https://doi.org/10.1016/S0040-4039(01)90553-2 |
[(1R,3R,4R,4aS,8aR)-3,4,8,8a-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] acetate
|
101297704 |
Click to see
CC1CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C)C)OC(=O)C
|
360.50 |
unknown |
https://doi.org/10.1016/S0040-4039(01)90553-2 |
[3,4,8,8a-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] 2-methylbut-2-enoate
|
162972514 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC3=CC(=O)OC3)C
|
400.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
[3,4,8,8a-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-1,2,3,4a,5,6-hexahydronaphthalen-1-yl] acetate
|
15559123 |
Click to see
CC1CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C)C)OC(=O)C
|
360.50 |
unknown |
https://doi.org/10.1016/S0040-4039(01)90553-2 |
[4,5,7a,7b-tetramethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]-2,3,3a,5,6,7-hexahydro-1aH-naphtho[1,2-b]oxiren-7-yl] acetate
|
15559127 |
Click to see
CC1CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCC4C2(O4)C)C)OC(=O)C
|
376.50 |
unknown |
https://doi.org/10.1016/S0040-4039(01)90553-2 |
3-[2-(1,2,4a,5-tetramethyl-4-oxo-3,7,8,8a-tetrahydro-2H-naphthalen-1-yl)ethyl]-2H-furan-5-one
|
73835018 |
Click to see
CC1CC(=O)C2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C)C
|
316.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
3-[2-[(1R,2R,4aR,8aS)-1,2,4a,5-tetramethyl-4-oxo-3,7,8,8a-tetrahydro-2H-naphthalen-1-yl]ethyl]-2H-furan-5-one
|
21771877 |
Click to see
CC1CC(=O)C2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C)C
|
316.40 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
3-[2-[(1R,2R,4R,4aR,8aS)-4-hydroxy-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-2H-furan-5-one
|
21771876 |
Click to see
CC1CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCC=C2C)C)O
|
318.40 |
unknown |
https://doi.org/10.1016/S0040-4039(01)81296-X |
Cssgxdljyushnp-znbotfofsa-
|
21771874 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C3(C(O3)CC2)C)C)(C)CCC4=CC(=O)OC4)C
|
416.50 |
unknown |
https://doi.org/10.1016/S0040-4039(01)81296-X |
Cssgxdljyushnp-zspjbmevsa-
|
21771875 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C3(C(O3)CC2)C)C)(C)CCC4=CC(=O)OC4)C
|
416.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
Solidagolactone II
|
101297701 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC3=CC(=O)OC3)C
|
400.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
Solidagolactone III
|
162972517 |
Click to see
CC=C(C)C(=O)OC1CC(C(C2C1(C(=CCC2)C)C)(C)CCC3=CC(=O)OC3)C
|
400.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)83202-1 |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
Bauerenol
|
287684 |
Click to see
CC1CCC2(CCC3(C4=CCC5C(C(CCC5(C4CCC3(C2C1C)C)C)O)(C)C)C)C
|
426.70 |
unknown |
https://doi.org/10.5650/JOS1996.48.139 https://doi.org/10.1021/NP50029A026 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Pentacarboxylic acids and derivatives
|
Angulatin A
|
86342462 |
Click to see
CC(C)C(=O)OCC12C(C(CC(C13C(C(C(C2OC(=O)C4=CC=CC=C4)OC(=O)C(C)C)C(O3)(C)C)O)(C)O)OC(=O)C)OC(=O)C
|
662.70 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
|
(1R,3S,4R,5S)-1,3,4-Trihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-cyclohexane-1-carboxylic acid
|
14158101 |
Click to see
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O)O
|
338.31 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
4-p-Coumaroylquinic acid
|
5281766 |
Click to see
C1C(C(C(CC1(C(=O)O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O
|
338.31 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
4,5-Dicaffeoylquinic acid
|
5281780 |
Click to see
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O
|
516.40 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
Chlorogenic Acid
|
1794427 |
Click to see
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
Cryptochlorogenic acid
|
9798666 |
Click to see
C1C(C(C(CC1(C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
Neochlorogenic acid
|
5280633 |
Click to see
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
|
354.31 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
|
Isoalbrassitriol
|
184224 |
Click to see
CC1(CCCC2(C1CCC(C2(CO)O)(C)O)C)C
|
256.38 |
unknown |
https://doi.org/10.1016/S0040-4039(01)81296-X https://doi.org/10.1016/S0031-9422(00)83202-1 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
|
Violaceoid E
|
139583290 |
Click to see
CCCCCC=CC1=C(C(=O)CC(C1O)O)CO
|
254.32 |
unknown |
https://doi.org/10.1016/S0040-4039(00)76420-3 https://doi.org/10.1246/BCSJ.42.812 https://doi.org/10.1246/NIKKASHI.1973.590 |
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
|
(5E)-5-[(E)-hex-4-en-2-ynylidene]furan-2-one
|
6538111 |
Click to see
CC=CC#CC=C1C=CC(=O)O1
|
160.17 |
unknown |
https://doi.org/10.1016/0031-9422(92)80433-F |
(5E)-5-[(Z)-oct-6-en-2,4-diynylidene]furan-2-one
|
6475136 |
Click to see
CC=CC#CC#CC=C1C=CC(=O)O1
|
184.19 |
unknown |
https://doi.org/10.1016/0031-9422(92)80433-F |
2(5H)-Furanone,4-hexadiynylidene)-
|
5380631 |
Click to see
CC#CC#CC=C1C=CC(=O)O1
|
158.15 |
unknown |
https://doi.org/10.1080/00021369.1978.10862991 https://doi.org/10.1016/0031-9422(92)80433-F |
5-Hexa-2,4-diynylidenefuran-2-one
|
265579 |
Click to see
CC#CC#CC=C1C=CC(=O)O1
|
158.15 |
unknown |
https://doi.org/10.1080/00021369.1978.10862991 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
Methyl 3-(3,4-dimethoxyphenyl)prop-2-enoate
|
94307 |
Click to see
COC1=C(C=C(C=C1)C=CC(=O)OC)OC
|
222.24 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
Methyl 3,4-dimethoxycinnamate
|
766745 |
Click to see
COC1=C(C=C(C=C1)C=CC(=O)OC)OC
|
222.24 |
unknown |
https://doi.org/10.1016/S0031-9422(99)00273-3 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
|
Caffeic Acid
|
689043 |
Click to see
C1=CC(=C(C=C1C=CC(=O)O)O)O
|
180.16 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid 3-O-p-coumaroyl glycosides
|
Tiliroside
|
5320686 |
Click to see
C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1007/S11418-007-0139-6 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
5378597 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
|
125528541 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O
|
610.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[(2-O-D-Apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
|
21722034 |
Click to see
C1C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)CO)O)O)O)(CO)O
|
580.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
|
102514494 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)OC6C(C(CO6)(CO)O)O)O)O)O)O)O
|
726.60 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
|
16724599 |
Click to see
C1C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)(CO)O
|
596.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
|
16724600 |
Click to see
C1C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)(CO)O
|
580.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[3-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
|
5465152 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)OC6C(C(CO6)(CO)O)O)O)O)O)O)O
|
726.60 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[6-[[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
|
73311342 |
Click to see
C1C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)(CO)O
|
596.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
3-[6-[[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
|
45359361 |
Click to see
C1C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)(CO)O
|
580.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
|
154497089 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
|
5462193 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
|
12313332 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Astragalin
|
5282102 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Isoquercetin
|
5280804 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Kaempferol 3-[apiosyl-(1->2)-galactoside]
|
5465153 |
Click to see
C1C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)CO)O)O)O)(CO)O
|
580.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Kaempferol-3-O-rutinoside
|
5318767 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O
|
594.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Quercetin 3-alloside
|
12304327 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O
|
464.40 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Rutin
|
5280805 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O
|
610.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |
Vitamin P
|
5293655 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O
|
610.50 |
unknown |
https://doi.org/10.1248/CPB.55.815 |