> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
|
3-Hydroxy-5-methoxybenzoic acid
|
7472024 |
Click to see
COC1=CC(=CC(=C1)O)C(=O)O
|
168.15 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lignans, neolignans and related compounds / Furanoid lignans
|
(+/-)-Pinoresinol
|
234817 |
Click to see
COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC)O
|
358.40 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Pinoresinol
|
73399 |
Click to see
COC1=C(C=CC(=C1)C2C3COC(C3CO2)C4=CC(=C(C=C4)O)OC)O
|
358.40 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids
|
(1R,4S,5R,9S,10S,13R,14R,16R)-14-(hydroxymethyl)-5,9-dimethyl-15-oxapentacyclo[11.3.1.01,10.04,9.014,16]heptadecane-5-carboxylic acid
|
101635460 |
Click to see
CC12CCCC(C1CCC34C2CCC(C3)C5(C4O5)CO)(C)C(=O)O
|
334.40 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
(1R,4S,5R,9S,10S,15S)-15-hydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
|
139031795 |
Click to see
CC12CCCC(C1CCC34C2CCC(C3)C(=C)C4O)(C)C(=O)O
|
318.40 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Candol B
|
101289732 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)CO
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
ent-16-Kauren-19-ol
|
529650 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)CO
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
ent-Kaur-16-en-19-ol
|
443465 |
Click to see
CC1(CCCC2(C1CCC34C2CCC(C3)C(=C)C4)C)CO
|
288.50 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Grandifloric acid
|
159930 |
Click to see
CC12CCCC(C1CCC34C2CCC(C3)C(=C)C4O)(C)C(=O)O
|
318.40 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Grandifloric acid
|
433554 |
Click to see
CC12CCCC(C1CCC34C2CCC(C3)C(=C)C4O)(C)C(=O)O
|
318.40 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Tigliane and ingenane diterpenoids
|
[(1R,2R,6S,10R,11R,13S,14R,15R)-13-acetyloxy-8-formyl-1-hydroxy-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2-(methylamino)benzoate
|
162901456 |
Click to see
CC1C(C2(C(C2(C)C)C3C1(C4C=C(C(=O)C4CC(=C3)C=O)C)O)OC(=O)C)OC(=O)C5=CC=CC=C5NC
|
521.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
(8-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6,6a,7,8-hexahydro-3aH-benzo[h][1]benzofuran-4-yl) 2-[2-(acetyloxymethyl)but-2-enoyloxymethyl]-4-hydroxybut-2-enoate
|
163066968 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CCO)C(=O)OC1CC(C2CC(C(=CC23C1C(=C)C(=O)O3)C)O)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
[(3aR,4R,6R,6aR,8S,10aR)-8-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-4,5,6,6a,7,8-hexahydro-3aH-benzo[h][1]benzofuran-4-yl] (E)-2-[[(E)-2-(acetyloxymethyl)but-2-enoyl]oxymethyl]-4-hydroxybut-2-enoate
|
101635459 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CCO)C(=O)OC1CC(C2CC(C(=CC23C1C(=C)C(=O)O3)C)O)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives
|
(9-Hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl) 2-[2-(acetyloxymethyl)but-2-enoyloxymethyl]-4-hydroxybut-2-enoate
|
162897221 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CCO)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)O)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
[(3aR,4R,6E,9R,10E,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (E)-2-[[(E)-2-(acetyloxymethyl)but-2-enoyl]oxymethyl]-4-hydroxybut-2-enoate
|
162897223 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CCO)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)O)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
[(E)-2-[[(1R,2R,4R,6R,8S,9Z,11R)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl]oxycarbonyl]but-2-enyl] (E)-2-(acetyloxymethyl)-4-hydroxybut-2-enoate
|
162924026 |
Click to see
CC=C(COC(=O)C(=CCO)COC(=O)C)C(=O)OC1CC2(C(O2)CC(C(=CC3C1C(=C)C(=O)O3)C)O)C
|
534.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
[(E)-2-[[(3aR,4R,6E,9S,10Z,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl]oxycarbonyl]but-2-enyl] (E)-2-(acetyloxymethyl)-4-hydroxybut-2-enoate
|
101635462 |
Click to see
CC=C(COC(=O)C(=CCO)COC(=O)C)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)O)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
[(E)-2-[[(3aR,4R,6E,9S,10Z,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl]oxycarbonyl]but-2-enyl] (E)-2-(acetyloxymethyl)but-2-enoate
|
101635461 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CC)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)O)C
|
502.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
2-[(8-Hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.04,6]tetradec-9-en-2-yl)oxycarbonyl]but-2-enyl 2-(acetyloxymethyl)-4-hydroxybut-2-enoate
|
162924025 |
Click to see
CC=C(COC(=O)C(=CCO)COC(=O)C)C(=O)OC1CC2(C(O2)CC(C(=CC3C1C(=C)C(=O)O3)C)O)C
|
534.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
2-[(9-Hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl)oxycarbonyl]but-2-enyl 2-(acetyloxymethyl)-4-hydroxybut-2-enoate
|
162997791 |
Click to see
CC=C(COC(=O)C(=CCO)COC(=O)C)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)O)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
2-[(9-Hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl)oxycarbonyl]but-2-enyl 2-(acetyloxymethyl)but-2-enoate
|
162884683 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CC)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)O)C
|
502.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Provincialin
|
5281494 |
Click to see
CC=C(CO)C(=O)OCC(=CCO)C(=O)OC1CC(=CCC(C(=CC2C1C(=C)C(=O)O2)C)OC(=O)C)C
|
518.60 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Guaianolides and derivatives
|
[(E)-2-[[(3aR,4R,6aR,9S,9aR,9bR)-9-methyl-3,6-dimethylidene-2,8-dioxo-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-4-yl]oxycarbonyl]but-2-enyl] (E)-2-(acetyloxymethyl)but-2-enoate
|
162852389 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CC)C(=O)OC1CC(=C)C2CC(=O)C(C2C3C1C(=C)C(=O)O3)C
|
500.50 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
2-[(9-Methyl-3,6-dimethylidene-2,8-dioxo-3a,4,5,6a,7,9,9a,9b-octahydroazuleno[4,5-b]furan-4-yl)oxycarbonyl]but-2-enyl 2-(acetyloxymethyl)but-2-enoate
|
162852388 |
Click to see
CC=C(COC(=O)C)C(=O)OCC(=CC)C(=O)OC1CC(=C)C2CC(=O)C(C2C3C1C(=C)C(=O)O3)C
|
500.50 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(4aR,6aR,6aR,6bR,8aS,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picen-3-ol
|
138113838 |
Click to see
CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC=C1C)C)C)C)(C)C)O)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
(6aR,6bR,8aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-ol
|
145706026 |
Click to see
CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)O)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
alpha-Amyrin
|
73170 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Beta-Amyrin
|
73145 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Lup-20(29)-en-3-ol, (3beta)-
|
521518 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
Lupeol
|
259846 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C
|
426.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives
|
Cholesterol
|
5997 |
Click to see
CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
|
386.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
|
(3S,8S,9S,10R,13R,14S,17R)-17-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
134688397 |
Click to see
CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
|
398.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
17-(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
|
122544 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
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/10.1016/0031-9422(92)83720-J |
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/10.1016/0031-9422(92)83720-J |
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/10.1016/0031-9422(92)83720-J |
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/10.1016/0031-9422(92)83720-J |
> Organoheterocyclic compounds / Benzofurans
|
Loliolide
|
100332 |
Click to see
CC1(CC(CC2(C1=CC(=O)O2)C)O)C
|
196.24 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |
> Phenylpropanoids and polyketides / Macrolides and analogues
|
(11R,12S,15S)-11-bromo-12,21-dihydroxy-15-(2-hydroxypropan-2-yl)-4,12-dimethyl-7-methylidene-16-oxatricyclo[16.3.1.03,8]docosa-1(21),3,18(22),19-tetraen-17-one
|
42599771 |
Click to see
CC1=C2CC3=C(C=CC(=C3)C(=O)OC(CCC(C(CCC2C(=C)CC1)Br)(C)O)C(C)(C)O)O
|
521.50 |
unknown |
https://doi.org/10.1016/0031-9422(92)83720-J |