> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
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(3S)-3-[(3S,3aS,5aR,6R,7S,9R,9aR)-9-acetyloxy-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-7-prop-1-en-2-yl-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]-3-acetyloxypropanoic acid
|
163104556 |
Click to see
CC(=CC1CC(CO1)C2CC=C3C2(CCC4C3(C(CC(C4(C)C(CC(=O)O)OC(=O)C)C(=C)C)OC(=O)C)C)C)C
|
570.80 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5aR,6R,7R,9R,9aR)-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] (2R,3R)-2-hydroxy-3-methylpentanoate
|
21581058 |
Click to see
CCC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
616.90 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5aR,6R,7R,9R,9aR)-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] (2R)-2-hydroxy-3-methylbutanoate
|
21581059 |
Click to see
CC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
602.80 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5aR,6R,7R,9R,9aR)-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] (E,2R)-2-hydroxy-3-methylpent-3-enoate
|
21581060 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
614.90 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5-[(2R,3R)-2-hydroxy-3-methylpentanoyl]oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] (2R,3R)-2-hydroxy-3-methylpentanoate
|
21581064 |
Click to see
CCC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(C)CC)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
747.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5-[(2R)-2-hydroxy-3-methylbutanoyl]oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] (E,2R)-2-hydroxy-3-methylpent-3-enoate
|
21581062 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(C)C)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
731.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5-[(E,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] (E,2R)-2-hydroxy-3-methylpent-3-enoate
|
21581065 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(=CC)C)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
743.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-9-[(2R)-2-hydroxy-3-methylbutanoyl]oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-5-yl] (2R,3R)-2-hydroxy-3-methylpentanoate
|
21581063 |
Click to see
CCC(C)C(C(=O)OC1CC2(C(CC=C2C3(C1C(C(CC3OC(=O)C(C(C)C)O)C(C)(C)O)(C)CCC(=O)OC)C)C4CC(OC4)C=C(C)C)C)O
|
733.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-9-[(E,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-5-yl] (2R,3R)-2-hydroxy-3-methylpentanoate
|
21581061 |
Click to see
CCC(C)C(C(=O)OC1CC2(C(CC=C2C3(C1C(C(CC3OC(=O)C(C(=CC)C)O)C(C)(C)O)(C)CCC(=O)OC)C)C4CC(OC4)C=C(C)C)C)O
|
745.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[5-(2-Hydroxy-3-methylbutanoyl)oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] 2-hydroxy-3-methylpent-3-enoate
|
73804852 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(C)C)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
731.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[5-(2-Hydroxy-3-methylpent-3-enoyl)oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] 2-hydroxy-3-methylpent-3-enoate
|
73804854 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(=CC)C)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
743.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[5-(2-Hydroxy-3-methylpentanoyl)oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] 2-hydroxy-3-methylpentanoate
|
73804853 |
Click to see
CCC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(C)CC)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
747.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[7-(2-Hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] 2-hydroxy-3-methylbutanoate
|
73804849 |
Click to see
CC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
602.80 |
unknown |
https://doi.org/10.1021/NP990013U |
[7-(2-Hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] 2-hydroxy-3-methylpent-3-enoate
|
73804850 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
614.90 |
unknown |
https://doi.org/10.1021/NP990013U |
[7-(2-Hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-9-yl] 2-hydroxy-3-methylpentanoate
|
73804848 |
Click to see
CCC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)OC)C(C)(C)O)O
|
616.90 |
unknown |
https://doi.org/10.1021/NP990013U |
[9-(2-Hydroxy-3-methylbutanoyl)oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-5-yl] 2-hydroxy-3-methylpentanoate
|
73108988 |
Click to see
CCC(C)C(C(=O)OC1CC2(C(CC=C2C3(C1C(C(CC3OC(=O)C(C(C)C)O)C(C)(C)O)(C)CCC(=O)OC)C)C4CC(OC4)C=C(C)C)C)O
|
733.00 |
unknown |
https://doi.org/10.1021/NP990013U |
[9-(2-Hydroxy-3-methylpent-3-enoyl)oxy-7-(2-hydroxypropan-2-yl)-6-(3-methoxy-3-oxopropyl)-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-5-yl] 2-hydroxy-3-methylpentanoate
|
73804851 |
Click to see
CCC(C)C(C(=O)OC1CC2(C(CC=C2C3(C1C(C(CC3OC(=O)C(C(=CC)C)O)C(C)(C)O)(C)CCC(=O)OC)C)C4CC(OC4)C=C(C)C)C)O
|
745.00 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5aR,6S,7R,9R,9aR)-9-[(2R,3R)-2-hydroxy-3-methylpentanoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
163106697 |
Click to see
CCC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
602.80 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5aR,6S,7R,9R,9aR)-9-[(2R)-2-hydroxy-3-methylbutanoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
163103806 |
Click to see
CC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
588.80 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5aR,6S,7R,9R,9aR)-9-[(E,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
163193636 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
600.80 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5aR,6S,7R,9R,9aR)-9-[(Z,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
163106434 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
600.80 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5-[(2R,3R)-2-hydroxy-3-methylpentanoyl]oxy-9-[(E,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
20055758 |
Click to see
CCC(C)C(C(=O)OC1CC2(C(CC=C2C3(C1C(C(CC3OC(=O)C(C(=CC)C)O)C(C)(C)O)(C)CCC(=O)O)C)C4CC(OC4)C=C(C)C)C)O
|
731.00 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5-[(2R)-2-hydroxy-3-methylbutanoyl]oxy-9-[(E,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
20055759 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(C)C)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
716.90 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5,9-bis[[(2R,3R)-2-hydroxy-3-methylpentanoyl]oxy]-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
20055761 |
Click to see
CCC(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(C)CC)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
733.00 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-5,9-bis[[(E,2R)-2-hydroxy-3-methylpent-3-enoyl]oxy]-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
20055762 |
Click to see
CC=C(C)C(C(=O)OC1CC(C(C2C1(C3=CCC(C3(CC2OC(=O)C(C(=CC)C)O)C)C4CC(OC4)C=C(C)C)C)(C)CCC(=O)O)C(C)(C)O)O
|
728.90 |
unknown |
https://doi.org/10.1021/NP990013U |
3-[(3S,3aS,5R,5aR,6R,7R,9R,9aR)-9-[(2R)-2-hydroxy-3-methylbutanoyl]oxy-5-[(2R,3R)-2-hydroxy-3-methylpentanoyl]oxy-7-(2-hydroxypropan-2-yl)-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoic acid
|
20055760 |
Click to see
CCC(C)C(C(=O)OC1CC2(C(CC=C2C3(C1C(C(CC3OC(=O)C(C(C)C)O)C(C)(C)O)(C)CCC(=O)O)C)C4CC(OC4)C=C(C)C)C)O
|
719.00 |
unknown |
https://doi.org/10.1021/NP990013U |
methyl (3S)-3-[(3S,3aS,5aR,6S,7S,9R,9aR)-9-acetyloxy-3a,6,9a-trimethyl-3-[(3S,5S)-5-(2-methylprop-1-enyl)oxolan-3-yl]-7-prop-1-en-2-yl-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]-3-acetyloxypropanoate
|
21581066 |
Click to see
CC(=CC1CC(CO1)C2CC=C3C2(CCC4C3(C(CC(C4(C)C(CC(=O)OC)OC(=O)C)C(=C)C)OC(=O)C)C)C)C
|
584.80 |
unknown |
https://doi.org/10.1021/NP990013U |
Methyl 3-acetyloxy-3-[9-acetyloxy-3a,6,9a-trimethyl-3-[5-(2-methylprop-1-enyl)oxolan-3-yl]-7-prop-1-en-2-yl-2,3,4,5,5a,7,8,9-octahydrocyclopenta[a]naphthalen-6-yl]propanoate
|
73804855 |
Click to see
CC(=CC1CC(CO1)C2CC=C3C2(CCC4C3(C(CC(C4(C)C(CC(=O)OC)OC(=O)C)C(=C)C)OC(=O)C)C)C)C
|
584.80 |
unknown |
https://doi.org/10.1021/NP990013U |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
[(1S,3bR,4R,5aR,10aR,10bS,11R,12aS)-1-[(2S,3S,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-hydroxyoxolan-3-yl]-4-hydroxy-6,6,10a,12a-tetramethyl-8-oxo-2,3b,4,5,5a,10b,11,12-octahydro-1H-indeno[5,4-g][2]benzoxepin-11-yl] (2R)-2-methylbutanoate
|
101711156 |
Click to see
CCC(C)C(=O)OC1CC2(C(CC=C2C3C1C4(C=CC(=O)OC(C4CC3O)(C)C)C)C5CC(OC5O)C(C(C)(C)O)O)C
|
604.80 |
unknown |
https://doi.org/10.1021/NP960159I |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids / Limonoids
|
(1S,3R,8R,11S,12S,15R,16R)-15-[(2S,3S,4S,5S)-2-ethoxy-4-hydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
10672963 |
Click to see
CCOC1C(C(C(O1)C=C(C)C)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,8R,11S,12S,15R,16R)-15-[(3S,4S,5S)-2-ethoxy-4-hydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
102064050 |
Click to see
CCOC1C(C(C(O1)C=C(C)C)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,8R,11S,12S,15R,16R)-15-[(3S,4S,5S)-2,4-dihydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
101693280 |
Click to see
CC(=CC1C(C(C(O1)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C)O)C
|
470.70 |
unknown |
https://doi.org/10.1016/0031-9422(95)00745-8 https://doi.org/10.1021/NP960594C |
(1S,3R,8S,11S,12S,15R,16R)-15-[(2S,3S,4S,5S)-2-ethoxy-4-hydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
162966508 |
Click to see
CCOC1C(C(C(O1)C=C(C)C)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(2S,3S,4S,5S)-3-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-5-(2-methylprop-1-enyl)oxolane-2,4-diol
|
10743082 |
Click to see
CC(=CC1C(C(C(O1)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)O)C)C)O)C
|
472.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(3S,4S,5S)-4-hydroxy-5-(2-methylprop-1-enyl)-3-[(1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxolan-2-one
|
10552245 |
Click to see
CC(=CC1C(C(C(=O)O1)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C)O)C
|
468.70 |
unknown |
https://doi.org/10.1021/NP960594C |
[(5R,7R,8R,9S,10S,11R,13S,17S)-17-[(2S,3S,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-hydroxyoxolan-3-yl]-7-hydroxy-4,4,10,13-tetramethyl-3-oxo-6,7,8,9,11,12,16,17-octahydro-5H-cyclopenta[a]phenanthren-11-yl] (2R)-2-methylbutanoate
|
101711154 |
Click to see
CCC(C)C(=O)OC1CC2(C(CC=C2C3C1C4(C=CC(=O)C(C4CC3O)(C)C)C)C5CC(OC5O)C(C(C)(C)O)O)C
|
588.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 https://doi.org/10.1021/NP960159I |
[(5R,7R,8R,9S,10S,11R,13S,17S)-17-[(2S,3S,5R)-5-[(2S)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-7-hydroxy-4,4,10,13-tetramethyl-3-oxo-6,7,8,9,11,12,16,17-octahydro-5H-cyclopenta[a]phenanthren-11-yl] 2-methylbutanoate
|
101711018 |
Click to see
CCC(C)C(=O)OC1CC2(C(CC=C2C3C1C4(C=CC(=O)C(C4CC3O)(C)C)C)C5CC(OC5O)C6C(O6)(C)C)C
|
570.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 https://doi.org/10.1021/NP960159I |
[(5R,7R,8R,9S,10S,11R,13S,17S)-7-acetyloxy-17-[(3S,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-hydroxyoxolan-3-yl]-4,4,10,13-tetramethyl-3-oxo-6,7,8,9,11,12,16,17-octahydro-5H-cyclopenta[a]phenanthren-11-yl] (2R)-2-methylbutanoate
|
101711155 |
Click to see
CCC(C)C(=O)OC1CC2(C(CC=C2C3C1C4(C=CC(=O)C(C4CC3OC(=O)C)(C)C)C)C5CC(OC5O)C(C(C)(C)O)O)C
|
630.80 |
unknown |
https://doi.org/10.1021/NP960159I https://doi.org/10.1016/0040-4020(96)00322-5 |
[(5R,7R,8R,9S,10S,11R,13S,17S)-7-acetyloxy-17-[(3S,5R)-5-[(2S)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-4,4,10,13-tetramethyl-3-oxo-6,7,8,9,11,12,16,17-octahydro-5H-cyclopenta[a]phenanthren-11-yl] (2R)-2-methylbutanoate
|
101711436 |
Click to see
CCC(C)C(=O)OC1CC2(C(CC=C2C3C1C4(C=CC(=O)C(C4CC3OC(=O)C)(C)C)C)C5CC(OC5O)C6C(O6)(C)C)C
|
612.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 https://doi.org/10.1021/NP960159I |
15-[2-Ethoxy-4-hydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
85227538 |
Click to see
CCOC1C(C(C(O1)C=C(C)C)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C
|
498.70 |
unknown |
https://doi.org/10.1021/NP960594C |
15-[2,4-Dihydroxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
3508618 |
Click to see
CC(=CC1C(C(C(O1)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C)O)C
|
470.70 |
unknown |
https://doi.org/10.1016/0031-9422(95)00745-8 |
3-(6-Hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)-5-(2-methylprop-1-enyl)oxolane-2,4-diol
|
85252446 |
Click to see
CC(=CC1C(C(C(O1)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(C6(C)C)O)C)C)O)C
|
472.70 |
unknown |
https://doi.org/10.1021/NP960594C |
4-Hydroxy-5-(2-methylprop-1-enyl)-3-(7,7,12,16-tetramethyl-6-oxo-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)oxolan-2-one
|
85182261 |
Click to see
CC(=CC1C(C(C(=O)O1)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C)O)C
|
468.70 |
unknown |
https://doi.org/10.1021/NP960594C |
Argenteanone A
|
391874 |
Click to see
CC(=CC1C(C(C(O1)O)C2CCC3(C2(CCC45C3CCC6C4(C5)CCC(=O)C6(C)C)C)C)O)C
|
470.70 |
unknown |
https://doi.org/10.1021/NP960594C https://doi.org/10.1016/0031-9422(95)00745-8 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
|
(1S,3R,6S,7S,8S,11S,12S,15R,16R)-15-[(2R,4R,5R)-5-hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
10575958 |
Click to see
CC1C2CCC3C4(CCC(C4(CCC35C2(C5)CCC1O)C)C(C)CC(C(C(=C)C)OO)O)C
|
460.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,6S,7S,8S,11S,12S,15R,16R)-15-[(2R,4S,5S)-5-hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
10411949 |
Click to see
CC1C2CCC3C4(CCC(C4(CCC35C2(C5)CCC1O)C)C(C)CC(C(C(=C)C)OO)O)C
|
460.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,6S,8R,11S,12S,15R,16R)-15-[(2R,4R,5R)-5-hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
10695874 |
Click to see
CC(CC(C(C(=C)C)OO)O)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C
|
474.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,8R,11S,12S,15R,16R)-15-[(2S,3S,4R)-3,4-dihydroxy-6-methylhept-5-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
102064049 |
Click to see
CC(C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C)C(C(C=C(C)C)O)O
|
456.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,8R,11S,12S,15R,16R)-15-[(2S,3S,4S)-3,4-dihydroxy-6-methylhept-5-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
10504015 |
Click to see
CC(C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C)C(C(C=C(C)C)O)O
|
456.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R,3S,4R)-1,3,4-trihydroxy-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
10695802 |
Click to see
CC(=CC(C(C(CO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C)O)O)C
|
472.70 |
unknown |
https://doi.org/10.1016/0031-9422(95)00745-8 https://doi.org/10.1021/NP960594C |
(2R,3S,4R)-2-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-6-methylhept-5-ene-1,3,4-triol
|
101693281 |
Click to see
CC(=CC(C(C(CO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C)O)O)C
|
474.70 |
unknown |
https://doi.org/10.1016/0031-9422(95)00745-8 |
(2S,3S,4R)-2-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-6-methylhept-5-ene-3,4-diol
|
102064051 |
Click to see
CC(C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C)C(C(C=C(C)C)O)O
|
458.70 |
unknown |
https://doi.org/10.1021/NP960594C |
(2S,3S,4S)-2-[(1S,3R,6S,8R,11S,12S,15R,16R)-6-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-6-methylhept-5-ene-3,4-diol
|
10599981 |
Click to see
CC(C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C)C(C(C=C(C)C)O)O
|
458.70 |
unknown |
https://doi.org/10.1021/NP960594C |
15-(3,4-Dihydroxy-6-methylhept-5-en-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
85163137 |
Click to see
CC(C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C)C(C(C=C(C)C)O)O
|
456.70 |
unknown |
https://doi.org/10.1021/NP960594C |
15-(5-Hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl)-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
85135698 |
Click to see
CC1C2CCC3C4(CCC(C4(CCC35C2(C5)CCC1O)C)C(C)CC(C(C(=C)C)OO)O)C
|
460.70 |
unknown |
https://doi.org/10.1021/NP960594C |
15-(5-Hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
85235764 |
Click to see
CC(CC(C(C(=C)C)OO)O)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C
|
474.70 |
unknown |
https://doi.org/10.1021/NP960594C |
2-(6-Hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)-6-methylhept-5-ene-1,3,4-triol
|
78157201 |
Click to see
CC(=CC(C(C(CO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C)O)O)C
|
474.70 |
unknown |
https://doi.org/10.1016/0031-9422(95)00745-8 |
2-(6-Hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl)-6-methylhept-5-ene-3,4-diol
|
85200570 |
Click to see
CC(C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C)C(C(C=C(C)C)O)O
|
458.70 |
unknown |
https://doi.org/10.1021/NP960594C |
7,7,12,16-Tetramethyl-15-(1,3,4-trihydroxy-6-methylhept-5-en-2-yl)pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-one
|
85109920 |
Click to see
CC(=CC(C(C(CO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C)O)O)C
|
472.70 |
unknown |
https://doi.org/10.1016/0031-9422(95)00745-8 |
> Organoheterocyclic compounds / Benzofurans / Flavaglines
|
1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxamide
|
78180418 |
Click to see
COC1=CC=C(C=C1)C23C(C(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C(=O)N)C5=CC=CC=C5
|
477.50 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives
|
(2R)-2-methyl-N-[(2S)-1-[(E)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]butanamide
|
163195185 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C=CC2=CC=CC=C2
|
300.40 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
|
(2R)-N-[(2S)-1-[(1R,9R,10R,11S,12S)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbutanamide
|
124389106 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
630.70 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
(2R)-N-[(2S)-1-[(1R,9R,10S,11R,12S)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbutanamide
|
124708178 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
630.70 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
[(1R,9R,10R,11S,12R)-1-hydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-11-[(2S)-2-(2-methylbutanoylamino)pyrrolidine-1-carbonyl]-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-12-yl] acetate
|
101118317 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)OC(=O)C)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
672.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
[(1R,9R,10R,11S,12R)-1-hydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-11-[(2S)-2-[[(2R)-2-methylbutanoyl]amino]pyrrolidine-1-carbonyl]-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-12-yl] acetate
|
162907453 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)OC(=O)C)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
672.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
[(1S,9S,10R,11S,12R)-1-hydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-11-[(2S)-2-[[(2S)-2-methylbutanoyl]amino]pyrrolidine-1-carbonyl]-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-12-yl] acetate
|
162907460 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)OC(=O)C)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
672.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
[1-Hydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-11-[2-(2-methylbutanoylamino)pyrrolidine-1-carbonyl]-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-trien-12-yl] acetate
|
75026712 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)OC(=O)C)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
672.80 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
N-[1-[(1S,9S)-1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbutanamide
|
137705524 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
630.70 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |
N-[1-[1,12-dihydroxy-3,5-dimethoxy-9-(4-methoxyphenyl)-10-phenyl-8-oxatricyclo[7.2.1.02,7]dodeca-2(7),3,5-triene-11-carbonyl]pyrrolidin-2-yl]-2-methylbutanamide
|
75026713 |
Click to see
CCC(C)C(=O)NC1CCCN1C(=O)C2C(C3(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C5=CC=C(C=C5)OC)C6=CC=CC=C6
|
630.70 |
unknown |
https://doi.org/10.1016/0040-4020(96)00322-5 |