> Alkaloids and derivatives / Amaryllidaceae alkaloids / Homolycorine-type amaryllidaceae alkaloids
|
Masonin
|
168922 |
Click to see
CN1CCC2=CCC3C(C21)C4=CC5=C(C=C4C(=O)O3)OCO5
|
299.32 |
unknown |
https://doi.org/10.1016/J.PHYMED.2008.05.004 |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
|
Methyl 3,4,5-trimethoxybenzoate
|
15956 |
Click to see
COC1=CC(=CC(=C1OC)OC)C(=O)OC
|
226.23 |
unknown |
https://doi.org/10.1016/0031-9422(93)80054-V https://doi.org/10.1139/V07-155 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
Lobatrienolide
|
11012596 |
Click to see
CC(=C)C1CC(CCC1(C)C=C)C2=CCC(OC2=O)C(C)(C)O
|
318.40 |
unknown |
https://doi.org/10.1021/NP900485T |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(23R,24S)-23,24-Dihydroxy-25-methoxy-5alpha-tirucall-7-en-3-one
|
14021539 |
Click to see
CC(CC(C(C(C)(C)OC)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C
|
488.70 |
unknown |
https://doi.org/10.1021/NP900485T |
(2S,4aS,6aS,6aR,6bS,8aS,9R,12aS,14aS,14bR)-2,4a,6a,6a,8a,9,14a-heptamethyl-10-oxo-3,4,5,6,6b,7,8,9,11,12,12a,13,14,14b-tetradecahydro-1H-picene-2-carboxylic acid
|
14108946 |
Click to see
CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C)C
|
456.70 |
unknown |
via CMAUP database |
(3S,4R,6S)-6-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptane-2,3,4-triol
|
21638425 |
Click to see
CC(CC(C(C(C)(C)O)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)C)O)C)C)C
|
476.70 |
unknown |
https://doi.org/10.1021/NP900485T |
(4R,4aS,6aS,6aS,6bR,8aS,11S,12aR,14aS,14bS)-11-(hydroxymethyl)-4,4a,6a,6b,8a,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
|
14108942 |
Click to see
CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)CO)C)C)C)C)C
|
442.70 |
unknown |
via CMAUP database |
(5R,9R,10R,13S,14S,17S)-17-[(2R,3S,5R)-5-[(1R)-1-hydroxy-2-methylprop-2-enyl]-2-methoxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
163025968 |
Click to see
CC(=C)C(C1CC(C(O1)OC)C2CCC3(C2(CCC4C3=CCC5C4(CCC(=O)C5(C)C)C)C)C)O
|
484.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
(5R,9R,10R,13S,14S,17S)-17-[(2R,3S,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
73353494 |
Click to see
CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CCC4C5CC(OC5OC)C(C(C)(C)O)O)C)C)C
|
502.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
(5R,9R,10R,13S,14S,17S)-17-[(2S,3S,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
162876783 |
Click to see
CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CCC4C5CC(OC5OC)C(C(C)(C)O)O)C)C)C
|
502.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
17-[5-(1-Hydroxy-2-methoxy-2-methylpropyl)-2-methoxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
22297355 |
Click to see
CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CCC4C5CC(OC5OC)C(C(C)(C)OC)O)C)C)C
|
516.80 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
17-[5-(1-Hydroxy-2-methylprop-2-enyl)-2-methoxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
163025967 |
Click to see
CC(=C)C(C1CC(C(O1)OC)C2CCC3(C2(CCC4C3=CCC5C4(CCC(=O)C5(C)C)C)C)C)O
|
484.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
17-[5-(1,2-Dihydroxy-2-methylpropyl)-2-hydroxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
15560458 |
Click to see
CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CCC4C5CC(OC5O)C(C(C)(C)O)O)C)C)C
|
488.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
17-[5-(1,2-Dihydroxy-2-methylpropyl)-2-methoxyoxolan-3-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
45360119 |
Click to see
CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CCC4C5CC(OC5OC)C(C(C)(C)O)O)C)C)C
|
502.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
21alpha,25-Dimethylmelianodiol
|
21668673 |
Click to see
CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CCC4C5CC(OC5OC)C(C(C)(C)OC)O)C)C)C
|
516.80 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
29-Hydroxyfriedelan-3-one
|
14108943 |
Click to see
CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)CO)C)C)C)C)C
|
442.70 |
unknown |
via CMAUP database |
4,4,10,13,14-Pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
14021536 |
Click to see
CC(CC(C(C(C)(C)O)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C
|
474.70 |
unknown |
https://doi.org/10.1021/NP900485T |
5-(3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-(2-hydroxypropan-2-yl)oxan-3-ol
|
320908 |
Click to see
CC1(C(CCC2(C1CC=C3C2CCC4(C3(CCC4C5CC(C(OC5)C(C)(C)O)O)C)C)C)O)C
|
474.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
6-(3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylheptane-2,3,4-triol
|
13967180 |
Click to see
CC(CC(C(C(C)(C)O)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)C)O)C)C)C
|
476.70 |
unknown |
https://doi.org/10.1021/NP900485T |
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 |
via CMAUP database |
Friedelin
|
91472 |
Click to see
CC1C(=O)CCC2C1(CCC3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C)C)C)C)C)C
|
426.70 |
unknown |
via CMAUP database |
Hennadiol
|
489919 |
Click to see
CC1(C2CCC3(C(C2(CCC1O)C)CCC4C3(CCC5(C4C(CC5)C(=C)CO)C)C)C)C
|
442.70 |
unknown |
via CMAUP database |
Phellochin
|
14021541 |
Click to see
CC(CC(C(C(C)(C)OC)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C
|
488.70 |
unknown |
https://doi.org/10.1021/NP900485T |
Piscidinol A
|
12004524 |
Click to see
CC(CC(C(C(C)(C)O)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C
|
474.70 |
unknown |
https://doi.org/10.1021/NP900485T |
Pristimerin
|
159516 |
Click to see
CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)OC)C)C)C)C)O
|
464.60 |
unknown |
via CMAUP database |
Ursolic Acid
|
64945 |
Click to see
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O
|
456.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids / Limonoids
|
(5R,7R,8R,9R,10R,13S,17S)-17-[(2R,3S,5R)-5-[(1S)-1,2-dihydroxy-2-methylpropyl]-2-methoxyoxolan-3-yl]-7-hydroxy-4,4,8,10,13-pentamethyl-1,2,5,6,7,9,11,12,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
163097109 |
Click to see
CC1(C2CC(C3(C(C2(CCC1=O)C)CCC4(C3=CCC4C5CC(OC5OC)C(C(C)(C)O)O)C)C)O)C
|
518.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
[(5R,6R,7S,8R,9R,10R,13R,17S)-7-acetyloxy-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17-hexahydro-5H-cyclopenta[a]phenanthren-6-yl] acetate
|
102059605 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(C(=O)C=C4C3(C1OC(=O)C)C)C5=COC=C5)C)C)(C)C
|
508.60 |
unknown |
https://doi.org/10.1016/J.PHYMED.2008.05.004 |
[(5R,6R,7S,8R,9R,10R,13S,17R)-7-acetyloxy-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17-hexahydro-5H-cyclopenta[a]phenanthren-6-yl] acetate
|
14378498 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(C(=O)C=C4C3(C1OC(=O)C)C)C5=COC=C5)C)C)(C)C
|
508.60 |
unknown |
https://doi.org/10.1016/0031-9422(93)80054-V https://doi.org/10.1139/V07-155 |
[(5R,6S,7S,8R,9R,10R,13S,17R)-7-acetyloxy-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-6-yl] acetate
|
101316752 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(CC=C4C3(C1OC(=O)C)C)C5=COC=C5)C)C)(C)C
|
494.60 |
unknown |
https://doi.org/10.1016/J.PHYMED.2008.05.004 |
[(5S,6R,7S,8R,9R,10R,13S,17R)-7-acetyloxy-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3-oxo-5,6,7,9,11,12,16,17-octahydrocyclopenta[a]phenanthren-6-yl] acetate
|
162964720 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(CC=C4C3(C1OC(=O)C)C)C5=COC=C5)C)C)(C)C
|
494.60 |
unknown |
https://doi.org/10.1039/P19790002959 |
[17-(3-furyl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17-hexahydro-5H-cyclopenta[a]phenanthren-7-yl] acetate
|
500060 |
Click to see
CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C4=CC(=O)C(C4(CC3)C)C5=COC=C5)C)C)(C)C
|
450.60 |
unknown |
https://doi.org/10.1139/V07-155 https://doi.org/10.1016/J.PHYMED.2008.05.004 |
[18-Acetyloxy-6-(furan-3-yl)-1,7,11,15,15-pentamethyl-5,14-dioxo-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadec-12-en-17-yl] acetate
|
14485930 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(C(=O)C5C4(C3(C1OC(=O)C)C)O5)C6=COC=C6)C)C)(C)C
|
524.60 |
unknown |
https://doi.org/10.1139/V07-155 |
[6-(Furan-3-yl)-1,7,11,15,15-pentamethyl-5,14-dioxo-3-oxapentacyclo[8.8.0.02,4.02,7.011,16]octadec-12-en-18-yl] acetate
|
500067 |
Click to see
CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C45C(O4)C(=O)C(C5(CC3)C)C6=COC=C6)C)C)(C)C
|
466.60 |
unknown |
https://doi.org/10.1139/V07-155 https://doi.org/10.1016/J.PHYMED.2008.05.004 |
[7-acetyloxy-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3,16-dioxo-6,7,9,11,12,17-hexahydro-5H-cyclopenta[a]phenanthren-6-yl] acetate
|
14378497 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(C(=O)C=C4C3(C1OC(=O)C)C)C5=COC=C5)C)C)(C)C
|
508.60 |
unknown |
https://doi.org/10.1016/0031-9422(93)80054-V https://doi.org/10.1139/V07-155 |
17-[5-(1,2-Dihydroxy-2-methylpropyl)-2-methoxyoxolan-3-yl]-7-hydroxy-4,4,8,10,13-pentamethyl-1,2,5,6,7,9,11,12,16,17-decahydrocyclopenta[a]phenanthren-3-one
|
74082986 |
Click to see
CC1(C2CC(C3(C(C2(CCC1=O)C)CCC4(C3=CCC4C5CC(OC5OC)C(C(C)(C)O)O)C)C)O)C
|
518.70 |
unknown |
https://doi.org/10.1016/J.BMC.2011.01.007 |
6alpha-Acetoxyepoxyazadiradione
|
101596702 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(C(=O)C5C4(C3(C1OC(=O)C)C)O5)C6=COC=C6)C)C)(C)C
|
524.60 |
unknown |
https://doi.org/10.1139/V07-155 |
Azadiradione
|
12308714 |
Click to see
CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C4=CC(=O)C(C4(CC3)C)C5=COC=C5)C)C)(C)C
|
450.60 |
unknown |
https://doi.org/10.1139/V07-155 https://doi.org/10.1016/J.PHYMED.2008.05.004 |
Dysobinin
|
11167838 |
Click to see
CC(=O)OC1C2C(C(=O)C=CC2(C3CCC4(C(CC=C4C3(C1OC(=O)C)C)C5=COC=C5)C)C)(C)C
|
494.60 |
unknown |
https://doi.org/10.1016/0031-9422(93)80054-V https://doi.org/10.1139/V07-155 |
Epoxyazadiradione
|
49863985 |
Click to see
CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C45C(O4)C(=O)C(C5(CC3)C)C6=COC=C6)C)C)(C)C
|
466.60 |
unknown |
https://doi.org/10.1016/J.PHYMED.2008.05.004 https://doi.org/10.1139/V07-155 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / 17-furanylsteroids and derivatives
|
[(7R,8R,9R,10R,13S,17R)-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-3-oxo-7,9,11,12,16,17-hexahydrocyclopenta[a]phenanthren-7-yl] acetate
|
101846445 |
Click to see
CC(=O)OC1C=C2C(C(=O)C=CC2(C3C1(C4=CCC(C4(CC3)C)C5=COC=C5)C)C)(C)C
|
434.60 |
unknown |
https://doi.org/10.1139/V07-155 |
[17-(Furan-3-yl)-4,4,8,10,13-pentamethyl-3-oxo-7,9,11,12,16,17-hexahydrocyclopenta[a]phenanthren-7-yl] acetate
|
163010768 |
Click to see
CC(=O)OC1C=C2C(C(=O)C=CC2(C3C1(C4=CCC(C4(CC3)C)C5=COC=C5)C)C)(C)C
|
434.60 |
unknown |
https://doi.org/10.1139/V07-155 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
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(93)80054-V |
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(93)80054-V |
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(93)80054-V |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
|
[(1R,2R,6S,8S,11R,12S,13R,16R,17R,19S,20R)-17-acetyloxy-19-hydroxy-1,9,11,16-tetramethyl-8-(5-oxo-2H-furan-4-yl)-5,14-dioxapentacyclo[11.6.1.02,11.06,10.016,20]icos-9-en-12-yl] (E)-2-methylbut-2-enoate
|
102165068 |
Click to see
CC=C(C)C(=O)OC1C2C3C(CO2)(C(CC(C3(C4C1(C5=C(C(CC5OCC4)C6=CCOC6=O)C)C)C)O)OC(=O)C)C
|
584.70 |
unknown |
https://doi.org/10.1021/NP900485T |
Chisonimbolinin F
|
44604739 |
Click to see
CC=C(C)C(=O)OC1C2C3C(CO2)(C(CC(C3(C4C1(C5=C(C(CC5OCC4)C6=CCOC6=O)C)C)C)O)OC(=O)C)C
|
584.70 |
unknown |
https://doi.org/10.1021/NP900485T |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
|
(6aS,6bS,8aS,12aR,14aR)-3-hydroxy-4,6a,6b,8a,11,14a-hexamethyl-8,9,12,12a,13,14-hexahydro-7H-picen-2-one
|
46881919 |
Click to see
CC1=CCC2(CCC3(C4=CC=C5C(=C(C(=O)C=C5C4(CCC3(C2C1)C)C)O)C)C)C
|
404.60 |
unknown |
via CMAUP database |
Tingenone
|
101520 |
Click to see
CC1CC2C(CCC3(C2(CCC4(C3=CC=C5C4=CC(=O)C(=C5C)O)C)C)C)(CC1=O)C
|
420.60 |
unknown |
via CMAUP database |