Exact Mass: 458.3872
Exact Mass Matches: 458.3872
Found 500 metabolites which its exact mass value is equals to given mass value 458.3872
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Soyasapogenol B
Soyasapogenol b-1, also known as 24-hydroxysophoradiol, is a member of the class of compounds known as triterpenoids. Triterpenoids are terpene molecules containing six isoprene units. Soyasapogenol b-1 is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Soyasapogenol b-1 can be synthesized from oleanane. Soyasapogenol b-1 is also a parent compound for other transformation products, including but not limited to, soyasapogenol B 3-O-beta-glucuronide, soyasaponin III, and soyasaponin I. Soyasapogenol b-1 can be found in soy bean, which makes soyasapogenol b-1 a potential biomarker for the consumption of this food product. Soyasapogenol B is a pentacyclic triterpenoid that is oleanane containing a double bond between positions 12 and 13 and substituted by hydroxy groups at the 3beta, 22beta and 24-positions. It derives from a hydride of an oleanane. Soyasapogenol B is a natural product found in Astragalus mongholicus, Melilotus messanensis, and other organisms with data available. See also: Trifolium pratense flower (part of); Medicago sativa whole (part of). Soyasapogenol B, also known as 24-hydroxysophoradiol, belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Soyasapogenol B is an extremely weak basic (essentially neutral) compound (based on its pKa). Soyasapogenol B is found in alfalfa. Soyasapogenol B is a constituent of soya bean saponin, Medicago, Astragalus, and Trifolium species. Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2]. Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2].
Soyasapogenol F
Soyasapogenol F is found in herbs and spices. Soyasapogenol F is a constituent of Trifolium pratense (red clover). Constituent of Trifolium pratense (red clover). Soyasapogenol F is found in tea and herbs and spices.
22alpha-Hydroxyerythrodiol
22alpha-Hydroxyerythrodiol is found in fats and oils. 22alpha-Hydroxyerythrodiol is a constituent of Camellia sasanqua Constituent of Camellia sasanqua. 22alpha-Hydroxyerythrodiol is found in tea and fats and oils.
Longispinogenin
Longispinogenin is a constituent of Calendula officinalis (pot marigold) Constituent of Calendula officinalis (pot marigold)
(3b,24x)-Cycloartane-3-oxo-24,25-diol
(3b,24x)-Cycloartane-3-oxo-24,25-diol is found in fruits. (3b,24x)-Cycloartane-3-oxo-24,25-diol is a constituent of Artocarpus heterophyllus (jackfruit). Constituent of Artocarpus heterophyllus (jackfruit). (3b,24x)-Cycloartane-3-oxo-24,25-diol is found in fruits.
Lucidumol B
Lucidumol B is found in mushrooms. Lucidumol B is a constituent of Ganoderma lucidum (reishi).
Heliantriol A1
Heliantriol A1 is found in fats and oils. Heliantriol A1 is isolated from flowers of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Isolated from flowers of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Heliantriol A1 is found in fats and oils.
(20S,24E)-20,26-Dihydroxy-24-dammaren-3-one
(20S,24E)-20,26-Dihydroxy-24-dammaren-3-one is found in fruits. (20S,24E)-20,26-Dihydroxy-24-dammaren-3-one is a constituent of Mangifera indica (mango). Constituent of Mangifera indica (mango). (20S,24E)-20,26-Dihydroxy-24-dammaren-3-one is found in fruits.
Heliantriol B2
Heliantriol B2 is found in fruits. Heliantriol B2 is a constituent of Calendula officinalis (pot marigold), Helianthus annuus (sunflower) and Stenocereus thurberi (organ pipe cactus) Constituent of Calendula officinalis (pot marigold), Helianthus annuus (sunflower) and Stenocereus thurberi (organ pipe cactus). Heliantriol B2 is found in fruits.
Heliantriol F
Heliantriol F is found in fats and oils. Heliantriol F is a constituent of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Constituent of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Heliantriol F is found in sunflower and fats and oils.
(2alpha,3beta)-20(29)-Lupene-2,3,28-triol
(2alpha,3beta)-20(29)-Lupene-2,3,28-triol is found in green vegetables. (2alpha,3beta)-20(29)-Lupene-2,3,28-triol is a constituent of Rheum rhabarbarum (rhubarb). Constituent of Rheum rhabarbarum (rhubarb). 20(29)-Lupene-2a,3b,28-triol is found in green vegetables.
(3xi,16xi,21xi)-12-Ursene-3,16,21-triol
(3xi,16xi,21xi)-12-Ursene-3,16,21-triol is a constituent of the flowers of Calendula officinalis (pot marigold) Constituent of the flowers of Calendula officinalis (pot marigold)
Quasiprotopanaxatriol
Quasiprotopanaxatriol is found in tea. Quasiprotopanaxatriol is isolated from ginseng. Isolated from ginseng. Quasiprotopanaxatriol is found in tea.
Coriandrinonediol
Coriandrinonediol is found in coriander. Coriandrinonediol is a constituent of Coriandrum sativum (coriander). Constituent of Coriandrum sativum (coriander). Coriandrinonediol is found in coriander and herbs and spices.
Heterobetulin
Heterobetulin is found in fats and oils. Heterobetulin is a constituent of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Constituent of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Heterobetulin is found in fats and oils.
Heliantriol B1
Heliantriol B1 is found in fats and oils. Heliantriol B1 is a constituent of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Constituent of Helianthus annuus (sunflower) and Calendula officinalis (pot marigold). Heliantriol B1 is found in fats and oils.
Heliantriol C
Heliantriol C is found in fats and oils. Heliantriol C is a constituent of Calendula officinalis (pot marigold) and Helianthus annuus (sunflower). Constituent of Calendula officinalis (pot marigold) and Helianthus annuus (sunflower). Heliantriol C is found in sunflower and fats and oils.
(3beta,24xi)-Cycloart-25-ene-3,24,27-triol
(3beta,24xi)-Cycloart-25-ene-3,24,27-triol is found in fruits. (3beta,24xi)-Cycloart-25-ene-3,24,27-triol is a constituent of Mangifera indica (mango). Constituent of Mangifera indica (mango). (3beta,24xi)-Cycloart-25-ene-3,24,27-triol is found in fruits.
(5alpha,17beta)-3-Oxoandrostan-17-yl undecanoate
1-Phenyl-2-hexadecanoylamino-3-pyrrolidino-1-propanol
13alpha,14beta,17alpha-lanosta-7,24-diene-3beta,11beta,16alpha-triol
21alpha,30-dihydroxy-D:A-friedooleanan-3-one|7alpha,30-dihydroxyfriedelane-3-one
(2beta,3beta,22alpha)-form-12-Ursene-2,3,22-triol|urs-12-ene-2beta,3beta,22alpha-triol
(3S,4R,4aS,6bR,8aR,12bS,14aR)-icosahydro-3-hydroxy-14a-(hydroxymethyl)-4,4a,6b,8a,11,11,12b-heptamethylpicen-2(1H)-one|3alpha,25-dihydroxyfriedelan-2-one
lup-1beta,3beta,11alpha-triol|lup-20(29)-1beta,3beta,11alpha-triol|Nepetidin
17,24-epoxy-25-hydroxybaccharan-3-one
A natural product found in Aglaia foveolata.
Soyasapogenol B
Constituent of soya bean saponin, Medicago, Astragalus, Trifolium subspecies Soyasapogenol B is found in many foods, some of which are peanut, soy bean, tea, and pulses. Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2]. Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2].
3-oxolanost-9(11)-en-24S,25-diol|3-oxolanost-9(11)-ene-24S,25-diol
3alpha-hydroxy friedelan-27-oic acid|Trichadenic acid A
(5R,8R,9R,10R,13R,14R,17S)-17-[(2S,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
(1R,4R,4aS,6bR,8aR,12bS,14aS)-icosahydro-1-hydroxy-14a-(hydroxymethyl)-4,4a,6b,8a,11,11,12b-heptamethylpicen-3(2H)-one|1beta,25-dihydroxyfriedelan-3-one
(23R)-5alpha-Cycloart-24-ene-3beta,21,23-triol|(23S)-cycloart-24-ene-3beta,21,23-triol|(3beta,23R)-Cycloart-24-ene-3,21,23-triol
(2alpha,3beta,24E)-9,19-cyclolanost-24-ene-2,3,26-triol|genipatriol
(22E,24R)-24-ethyl-6beta-methoxy-5alpha-cholesta-7,22-diene-3beta,5-diol
Gorgostane-3beta-9alpha,5alpha,6beta,11alpha-tetrol
(E)-25-hydroperoxy-3beta-hydroxydammar-20,23-diene
22-(4-hydroxyphenyl)-2,4-dimethyl-3-docosenoic acid
14beta,15beta-epoxy-3beta-hydroxy-serratan-21beta-ol
12,13-dihydrooleanolic acid|3beta-hydroxy-oleanan-28-oic acid|3beta-Hydroxy-oleanan-28-saeure|oleanolic acid
(3beta,21alpha)-3,21-Dihydroxy-8-onoceren-7-one|7-oxo, onocer-8-ene-3beta,21alpha-diol
22R,25-epoxylanost-8-ene-3beta,24S-diol|inonotsuoxide A
22.alpha.-Hydroxy-3,4-secostict-4(23)-en-3-oic acid
21alpha,27-dihydroxy-D:A-frideooleanon-3-one|kokoondiol
(3beta,16beta,22alpha)-12-Oleanene-3,16,22-triol|olean-12-en-3beta,16beta,22alpha-triol
(21R,24R)-21,24-Cyclo-5alpha-cycloartane-3beta,21,25-triol
11alpha,20-dihydroxylupan-3-one|3-keto-lupane-11alpha,20-diol
(8beta,9alpha,11alpha)-12-Oleanene-3,9,11-triol|olean-12-en-3beta,9alpha,11alpha-triol
N3,N20,N20-Trimethyl-N3-(3-methyl-2-butenoyl)-3,20-diaminopregnan-12-ol
(3beta,6beta,16beta)-20(29)-Lupene-3,6,16-triol|3beta,6beta,16beta-Trihydroxylup-20(29)-ene
25,28-dihydroxy-D:A-friedo-oleanan-3-one|25,28-dihydroxy-D:A-friedooleanan-3-one
28-hydroxyzeylanol|6beta,28-dihydroxyfriedelan-3-one
(3S,8S,9R,10S,13S,14R,17S)-3,22-dihydroxy-21-oxo-D:B-friedobaccharan-5-ene|leonatriolone
(22E,24R)-3beta,5alpha-dihydroxy-6beta-ethoxyergosta-7,22-diene|fomentarol C
23,28-dihydroxy-beta-amyrin|23-hydroxyerythrodiol|3beta,23,28-trihydroxy-olean-12-ene|3beta,23,28-trihydroxyolean-12-ene|hederatriol|Olean-12-en-3beta,23,28-triol|olean-12-ene-3beta,23,28-triol
3,4-secocucurbita-4,24E-diene-3-hydroxy-26-carboxylic acid
3-oxo-12alpha,28-dihydroxyfriedelane|monospermondiol
24,25-Dihydroxydammar-20-en-3-one
A tetracyclic triterpenoid that is dammar-20-ene substituted by hydroxy groups at positions 24 and 25 and an oxo group at position 3. It has been isolated from the stems of Aglaia abbreviata.
(3S,7S,9R)-3,7-dihydroxy-7(8->9)abeo-lanost-24-en-8-one|spiroinonotsuoxodiol
(3beta,14beta,21alpha)-14,26-Epoxy-3,21-serratanediol
(E)-25-hydroperoxycycloart-23-en-3beta-ol|25-hydroperoxy-cycloart-23-en-3beta-ol|25-hydroperoxycycloart-23-en-3beta-ol
3-alpha-Hydroxy-friedelan-29-saeure|Octandrolic acid
(24R)-7beta,8beta-epoxy-14alpha-methoxy-4-methylene-24-methylcholestan-3beta-ol
21alpha,22alpha-epoxy-20alpha-hydroxy-20(30)-dihydrotaraxasterol
3beta-Hydroxy-5alpha-lanosta-7,11-dion|3beta-Hydroxy-lanostan-7,11-dion|3beta-hydroxy-lanostane-7,11-dione|7,11-Diketo-lanostanol-(3beta)
2beta,3beta,22alpha-trihydroxy-olean-12-ene|olean-12-ene-2beta,3beta,22alpha-triol
(20R,21S)-20,21-epoxytaraxastane-3beta,16beta-diol|faradiol alpha-epoxide
(6R,10S,11S)-(+)-10-deoxy-17xi-hydroxyiridal|10-Deoxy-17-hydroxyiridal|6S,10R,11R,17xi-10-desoxy-17-hydroxyiridal
6beta,20-dihydroxy-lupan-3-on|6beta,20-dihydroxy-lupan-3-one|6beta,20-dihydroxylupan-3-one|6beta-6,20-Dihydroxy-3-lupanone
(3beta,13alpha,14beta,17alpha,20S,23R,24R)-lanosta-7,25-diene-3,23,24-triol|turrapubesol A
(16S,20R)-dihydroxydammar-24-en-3-one|16(S),20(R)-dihydroxydammar-24-en-3-one
3beta,9alpha-dihydroxylanost-24-en-26-al|3??,9??-Dihydroxylanost-24-en-26-ol
20alpha,21alpha-epoxy-taraxastane-3beta,22alpha-diol|20??,21??-Epoxy-taraxastane-3??,22??-diol
10-hydroxybetulin|30-hydroxybetulin|3beta,28,30-lup-20(29)-ene triol|3beta,28,30-Lup-20(29)-enetriol|3beta,28,30-trihydroxylup-20(29)-ene
(22R)-cycloart-23-ene-3beta,22alpha,25-triol|(22S)-cycloart-23-ene-3beta,22alpha,25-triol
(3beta,9beta)-4alpha-demethyl-4alpha-carboxy-9,19-cyclolanost-3-ol
1α,25-dihydroxy-24a,24b,24c-trihomovitamin D3 / 1α,25-dihydroxy-24a,24b,24c-trihomocholecalciferol
1α,25-dihydroxy-26,27-dimethyl-24a-homovitamin D3 / 1α,25-dihydroxy-26,27-dimethyl-24a-homocholecalciferol
(5Z,7E)-(1S,3R,20S)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol
(7E,22E)-(1R,3R)-26,27-dimethyl-24a,24b-dihomo-19-nor-9,10-seco-5,7,22-cholestatriene-1,3,25-triol
(20S,24E)-20,26-Dihydroxy-24-dammaren-3-one
22a-Hydroxyerythrodiol
Longispinogenin
(3xi,16xi,21xi)-12-Ursene-3,16,21-triol
LUPENE TRIOL
Lucidumol B
(3beta,24xi)-Cycloart-25-ene-3,24,27-triol
Coflotriol
Heterobetulin
Heliantriol B1
Heliantriol C
Heliantriol F
(3b,24x)-Cycloartane-3-oxo-24,25-diol
(2alpha,3beta)-20(29)-Lupene-2,3,28-triol
Quasiprotopanaxatriol
1alpha,25-dihydroxy-24a,24b,24c-trihomovitamin D3
1alpha,25-dihydroxy-26,27-dimethyl-24a-homovitamin D3 / 1alpha,25-dihydroxy-26,27-dimethyl-24a-homocholecalciferol
1alpha,25-dihydroxy-26,27-dimethyl-24a-homo-20-epivitamin D3
Hexadecanamide, N-[(1R,2R)-2-hydroxy-2-phenyl-1-(1-pyrrolidinylmethyl)ethyl]-
[trans(trans)]-4,4-bis(4-pentylcyclohexyl)biphenyl
cabraleone
A tetracyclic triterpenoid isolated from Aglaia foveolata and Aglaia abbreviata.
(4S)-C(14a)-Homo-27-norgammacer-14-ene-3β,21α,24-triol
28,29-dihydroxyfriedelan-3-one
A pentacyclic triterpenoid that is friedelane substituted by hydroxy groups at positions 28 and 29 and an oxo group at position 3. Isolated from the stems of Maytenus diversifolia, it exhibits potent cytotoxicity against the A-549 lung carcinoma cells.
Dihydrobetulinic acid
A pentacyclic triterpenoid that is lupane having a 3beta-hydroxy and 28-carboxy substituents. Isolated from the leaves of Syzygium claviflorum, it exhibits anti-HIV and antileishmanial activity.
20S,24S-dihydroxydammer-25-en-3-one
A tetracyclic triterpenoid that is dammer-25-ene substituted by hydroxy groups at positions 20 and 24 and an oxo group at position 3 (the 24S-stereoisomer). It has been isolated from the stems of Aglaia abbreviata.
rubiarbonol L
A pentacyclic triterpenoid of the class of arborinane-type terpenoids isolated from the roots of Rubia yunnanensis.
595-15-3
Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2]. Soyasapogenol B, an ingredient of soybean, exerts anti-proliferative, anti-metastatic activities. Soyasapogenol B triggers endoplasmic reticulum stress, which mediates apoptosis and autophagy in colorectal cancer[1][2].
(3S,4S,6aR,6bS,8aR,9R,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol
(1S,3R,6S,7S,8R,11S,12S,15R,16R)-6-hydroxy-7,12,16-trimethyl-15-[(2R)-6-methylheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid
1-Phenyl-2-hexadecanoylamino-3-pyrrolidino-1-propanol
[3-Carboxy-2-(9-hydroxynonadecanoyloxy)propyl]-trimethylazanium
[3-Carboxy-2-(11-hydroxynonadecanoyloxy)propyl]-trimethylazanium
(2E)-2-[4-hydroxy-2-(3-hydroxypropyl)-3,4-dimethyl-3-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]cyclohexylidene]propanal
Lamesticumin F
A triterpenoid of the class of onoceranoid-type terpenoids isolated from the twigs of Lansium domesticum.
Celasdin B
A pentacyclic triterpenoid that is friedelin substituted by hydroxy groups at positions 16 and 28. It is isolated from the stems of Celastrus hindsii and exhibits anti-HIV activity.
(3S,4aR,6aR,6bR,8aS,11S,12aS,14bS)-11-(hydroxymethyl)-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,14-diol
(6aR,6aR,6bR,8aR,12aR,14S,14bS)-10,14-dihydroxy-4,4,6a,6b,9,9,12a,14b-octamethyl-3,4a,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydro-2H-picen-1-one
(12Z,15Z,18Z,21Z,24Z)-2-hydroxytriacontapentaenoic acid
A very long-chain polyunsaturated fatty acid that is (12Z,15Z,18Z,21Z,24Z)-triacontapentaenoic acid substituted at position 2 by a hydroxy group.
(2s,3r,4ar,6ar,6bs,8ar,9s,11r,12s,12as,14ar,14br)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1h-picene-2,3,9-triol
(1s,2s,3as,5as,9as,9br,11as)-1-[(2r)-5-hydroperoxy-6-methylhept-6-en-2-yl]-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-2-ol
2,5-dihydroxy-4,4,4'a,6',6',7a,8'a,10'a-octamethyl-tetradecahydrospiro[indene-1,2'-phenanthren]-1'-one
(4ar,6as,6bs,8as,9r,10r,12as,12bs,14as,14br)-10-hydroxy-2,2,4a,8a,9,12b,14a-heptamethyl-hexadecahydropicene-6a-carboxylic acid
(4as,5r,6r,8ar)-6-hydroxy-5-[(3e,7e,11e)-13-hydroxy-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-1,1,4a,6-tetramethyl-hexahydronaphthalen-2-one
15-(3-hydroxy-6-methylhept-5-en-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecane-6,14-diol
(1r,3as,3bs,7s,9as,9br,10r,11ar)-9a,11a-dimethyl-1-[(1s)-1-[(1r,2r)-2-methyl-2-[(2r)-3-methylbutan-2-yl]cyclopropyl]ethyl]-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthrene-7,9b,10-triol
(1r,3r,3ar,5ar,5br,6r,7ar,9s,11as,13as,13br)-3-isopropyl-3a,5a,8,8,11a,13a-hexamethyl-1h,2h,3h,4h,5h,5bh,6h,7h,7ah,9h,10h,11h,13h,13bh-cyclopenta[a]chrysene-1,6,9-triol
7-hydroxy-4-[2-(6-hydroxy-2,5,5,8a-tetramethyl-octahydronaphthalen-1-yl)ethyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-1h-naphthalen-2-one
(1s,3ar,3br,5ar,9ar,9bs,11ar)-1-[(2r,5s)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-3a,3b,6,6,9a-pentamethyl-dodecahydrocyclopenta[a]phenanthren-7-one
15-(5-hydroperoxy-6-methylhept-6-en-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-ol
2-[3-(6-hydroxy-4,8,12-trimethyltrideca-3,7,11-trien-1-yl)-2-(3-hydroxypropyl)-3,4-dimethylcyclohexylidene]propanal
3-[11-hydroxy-7-isopropyl-6,9a,9b,11a-tetramethyl-3-(prop-1-en-2-yl)-dodecahydro-1h-cyclopenta[a]phenanthren-6-yl]propanoic acid
(2r,4s)-2-[(1s,3r,6s,8r,11s,12s,15r,16r)-6-hydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl]-6-methylhept-5-ene-1,4-diol
1-(6-hydroperoxy-6-methylhept-4-en-2-yl)-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-ol
(4r,4as,6as,6br,8as,10r,12ar,12br,14as,14bs)-10-hydroxy-12b-(hydroxymethyl)-4,4a,6b,8a,11,11,14a-heptamethyl-tetradecahydro-1h-picen-3-one
1-(5,6-dihydroxy-6-methylhept-2-en-2-yl)-3a,3b,6,6,9a-pentamethyl-dodecahydrocyclopenta[a]phenanthren-7-one
(1s,3ar,3br,5s,5ar,7s,9ar,9br,11r,11ar)-3a,3b,6,6,9a-pentamethyl-1-(6-methylhepta-1,5-dien-2-yl)-dodecahydro-1h-cyclopenta[a]phenanthrene-5,7,11-triol
2-{6-hydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl}-6-methylhept-5-ene-1,4-diol
4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8,9-triol
1-(5,6-dimethylhept-3-en-2-yl)-5-ethoxy-9a,11a-dimethyl-1h,2h,3h,3ah,5h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-5a,7-diol
n-{1-[1-(dimethylamino)ethyl]-11-hydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl}-n,3-dimethylbut-2-enamide
1-[4-(3,3-dimethyloxiran-2-yl)-4-hydroxybutan-2-yl]-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-ol
1-hydroxy-14a-(hydroxymethyl)-4,4a,6b,8a,11,11,12b-heptamethyl-tetradecahydro-1h-picen-3-one
20-(hydroxymethyl)-1,7,7,11,16,20-hexamethylpentacyclo[13.8.0.0³,¹².0⁶,¹¹.0¹⁶,²¹]tricos-3-ene-8,19-diol
(3s,5s)-5-[(1s)-1-[(1r,3ar,5ar,7s,9as,11ar)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-2,2-dimethyloxolan-3-ol
(1s,3ar,3br,5ar,9as,9br,10r,11ar)-10-hydroxy-1-[(2r)-2-hydroxy-6-methylhept-5-en-2-yl]-3a,3b,6,6,9a-pentamethyl-dodecahydrocyclopenta[a]phenanthren-7-one
2',5'-dihydroxy-3-isopropyl-3a,4',4',5a,7'a,9a-hexamethyl-tetradecahydrospiro[cyclopenta[a]naphthalene-7,1'-inden]-6-one
(3r,4as,6as,6br,8ar,10s,12as,12br,13r,14br)-2,2,4a,6a,6b,9,9,12a-octamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-3,10,13-triol
(1s,3s,6r,8s,11r,12s,15r,16s,19s,21r,23r)-3,7,7,11,16,20,20-heptamethyl-24-oxahexacyclo[13.9.0.0¹,²³.0³,¹².0⁶,¹¹.0¹⁶,²¹]tetracosane-8,19-diol
(1r,3ar,5ar,5br,7r,7ar,11ar,11br,13ar,13bs)-7-hydroxy-1-(2-hydroxypropan-2-yl)-3a,5a,5b,8,8,11a-hexamethyl-tetradecahydro-1h-cyclopenta[a]chrysen-9-one
(2r,4r,4ar,6as,6br,8as,12as,12bs,14as,14br)-2-hydroxy-8a-(hydroxymethyl)-4,4a,6b,11,11,12b,14a-heptamethyl-tetradecahydro-1h-picen-3-one
(3s,4s,4as,6ar,6bs,8ar,9r,12as,14ar,14br)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol
(3r,5r,6s)-6-[(1r,3ar,5ar,7s,9as,11ar)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-methylhept-1-ene-3,5-diol
2-{7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-6-methylhept-5-ene-1,4-diol
3-isopropyl-3a,5a,8,8,11a,13a-hexamethyl-1h,2h,3h,4h,5h,5bh,6h,7h,7ah,9h,10h,11h,13h,13bh-cyclopenta[a]chrysene-1,6,9-triol
(3s,6ar,6bs,8s,8as,12as,14br)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8-diol
(1s,6r,11r,12r,15r,16r,20s,21r)-20-(hydroxymethyl)-1,7,7,11,16,20-hexamethylpentacyclo[13.8.0.0³,¹².0⁶,¹¹.0¹⁶,²¹]tricos-3-ene-8,19-diol
(3s,4ar,6br,9r,10r,10ar,11bs)-9-[(2r,4e)-6-hydroxy-6-methylhept-4-en-2-yl]-4,4,6b,10,11b-pentamethyl-1h,2h,3h,4ah,5h,6h,7h,8h,9h,10ah,11h-cyclohexa[a]fluorene-3,10-diol
(4r,4as,6as,6br,8r,8as,11s,12as,12bs,14as,14bs)-8-hydroxy-11-(hydroxymethyl)-4,4a,6b,8a,11,12b,14a-heptamethyl-tetradecahydro-1h-picen-3-one
(1r,3ar,5ar,7s,9as,11ar)-1-[(2r,4e)-6-hydroperoxy-6-methylhept-4-en-2-yl]-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-ol
2-{6-hydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl}-6-methylhept-5-ene-3,4-diol
(1s,3ar,3br,5ar,9ar,9br,11ar)-1-[(5r)-5,6-dihydroxy-6-methylhept-1-en-2-yl]-3a,3b,6,6,9a-pentamethyl-dodecahydrocyclopenta[a]phenanthren-7-one
(1r,3as,5ar,5br,7ar,9r,10r,11ar,11br,13ar,13br)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysene-9,10-diol
(1r,3s,3as,5as,5bs,6s,7ar,9s,11as,13ar,13bs)-3-isopropyl-3a,5a,8,8,11a,13a-hexamethyl-1h,2h,3h,4h,5h,5bh,6h,7h,7ah,9h,10h,11h,13h,13bh-cyclopenta[a]chrysene-1,6,9-triol
(3s,5r)-5-[(1s)-1-[(1r,3ar,5ar,7s,9as,11ar)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-2,2-dimethyloxolan-3-ol
(3s,3as,5as,5br,7as,11as,11br,13ar,13bs)-3-(2-hydroxypropan-2-yl)-5b,8,8,11a,13b-pentamethyl-hexadecahydrocyclopenta[a]chrysene-5a-carboxylic acid
(1s,3r,8s,11s,12s,15r,16r)-15-[(2r,5r)-5,6-dihydroxy-6-methylheptan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-one
(1r,3as,3bs,7r,9s,9ar,9bs,10r,11ar)-9a,11a-dimethyl-1-[(1s)-1-[(1r,2r)-2-methyl-2-[(2r)-3-methylbutan-2-yl]cyclopropyl]ethyl]-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-7,9,10-triol
15-(7-hydroxy-6-methylhept-5-en-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecane-5,6-diol
(5r,5as,7as,7br,9as,13as,13bs,15ar,15bs)-9a-(hydroxymethyl)-5,5a,7b,12,12,13b,15a-heptamethyl-tetradecahydro-1h-chryseno[2,1-c]oxepin-3-one
(4r,4as,6ar,6br,8as,12as,12bs,14ar,14br)-8a,14a-bis(hydroxymethyl)-4,4a,6b,11,11,12b-hexamethyl-tetradecahydro-1h-picen-3-one
9-(6-hydroxy-6-methylhept-4-en-2-yl)-4,4,6b,10,11b-pentamethyl-1h,2h,3h,4ah,5h,6h,7h,8h,9h,10ah,11h-cyclohexa[a]fluorene-3,10-diol
(1r,3as,3br,4s,5ar,9as,9bs,11ar)-4,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-1-[(2r,5e)-5-methylhept-5-en-2-yl]-dodecahydrocyclopenta[a]phenanthren-10-one
(4r,4as,6as,6br,7s,8ar,11r,12ar,12bs,14as,14bs)-7-hydroxy-11-(hydroxymethyl)-4,4a,6b,8a,11,12b,14a-heptamethyl-tetradecahydro-1h-picen-3-one
(1r,2s,3r,4as,6as,6br,8ar,10s,12as,12br,13r,14br)-1,2,4a,6a,6b,9,9,12a-octamethyl-2,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydro-1h-picene-3,10,13-triol
(3s,4s,4as,6ar,6bs,8ar,9r,12ar,14ar,14br)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol
4a-(hydroxymethyl)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-1,10-diol
(2r,3r,4as,6ar,6bs,8as,11r,12s,12ar,14as,14br)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1h-picene-2,3-diol
(3s,4as,6as,6br,8ar,10r,12as,12br,13r,14br)-2,2,4a,6a,6b,9,9,12a-octamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-3,10,13-triol
2,7,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-1-benzopyran-6-yl acetate
(1r,3as,3br,4s,7s,9as,9bs,11ar)-1-[(2r,4e)-6-hydroxy-6-methylhept-4-en-2-yl]-3a,6,6,9b,11a-pentamethyl-1h,2h,3h,3bh,4h,7h,8h,9h,9ah,10h,11h-cyclopenta[a]phenanthrene-4,7-diol
2-[(1z,2s,3r,4r)-2-(3-hydroxypropyl)-3,4-dimethyl-3-[(3e)-4-methyl-6-[(2s,3r)-3-methyl-3-(4-methylpent-3-en-1-yl)oxiran-2-yl]hex-3-en-1-yl]cyclohexylidene]propanal
(2s,3s,6s)-6-[(1s)-1-[(1r,3ar,5ar,7r,9as,11ar)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-methyloxan-2-ol
10-hydroxy-6b-(hydroxymethyl)-4,4a,8a,11,11,12b,14a-heptamethyl-tetradecahydro-1h-picen-3-one
(2r)-2,7,8-trimethyl-2-[(4s,8s)-4,8,12-trimethyltridecyl]-3,4-dihydro-1-benzopyran-6-yl acetate
(2e,6r)-6-[(3r,3ar,5as,6s,9ar,9bs)-6-(3-hydroxypropyl)-3a,5a,9b-trimethyl-7-(propan-2-ylidene)-octahydro-1h-cyclopenta[a]naphthalen-3-yl]-2-methylhept-2-enoic acid
(1s,3ar,3br,5ar,9ar,9bs,11ar)-1-[(2s,5r)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-3a,3b,6,6,9a-pentamethyl-dodecahydrocyclopenta[a]phenanthren-7-one
4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1h-picene-2,3,9-triol
(3e,5r,6s)-6-[(1s,3r,6s,8r,11s,12s,15r,16r)-6-hydroxy-7,7,12,16-tetramethylpentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl]-2-methylhept-3-ene-2,5-diol
6-[6-(3-hydroxypropyl)-3a,5a,9b-trimethyl-7-(propan-2-ylidene)-octahydro-1h-cyclopenta[a]naphthalen-3-yl]-2-methylhept-2-enoic acid
14β,15β-epoxy-3β-hydroxyserratan-21α-ol
{"Ingredient_id": "HBIN001375","Ingredient_name": "14\u03b2,15\u03b2-epoxy-3\u03b2-hydroxyserratan-21\u03b1-ol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7142","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
14β,15β-epoxy-3β-hydroxy-serratan-21β-ol
{"Ingredient_id": "HBIN001377","Ingredient_name": "14\u03b2,15\u03b2-epoxy-3\u03b2-hydroxy-serratan-21\u03b2-ol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7143","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
21-episerratriol
{"Ingredient_id": "HBIN003567","Ingredient_name": "21-episerratriol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC1(C(CCC2(C1CC=C3C2CCC4C(C3)(CCC5C4(CCC(C5(C)CO)O)C)C)C)O)C","Ingredient_weight": "458.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7017","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "91895438","DrugBank_id": "NA"}
24,25-dihydroxydammar-20-en-3-one
{"Ingredient_id": "HBIN004193","Ingredient_name": "24,25-dihydroxydammar-20-en-3-one","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C(=C)CCC(C(C)(C)O)O)C)C)C","Ingredient_weight": "458.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41458","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "138113725","DrugBank_id": "NA"}
24,25-epoxy-3β,23-dihydroxy-7-tirucallene
{"Ingredient_id": "HBIN004195","Ingredient_name": "24,25-epoxy-3\u03b2,23-dihydroxy-7-tirucallene","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7083","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3α,21β-dihydroxyserrat-14-en-24-ol
{"Ingredient_id": "HBIN007911","Ingredient_name": "3\u03b1,21\u03b2-dihydroxyserrat-14-en-24-ol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC1(C(CCC2(C1CC=C3C2CCC4C(C3)(CCC5C4(CCC(C5(C)CO)O)C)C)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6118","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β,21α-dihydroxyserrat-14-en-24-ol
{"Ingredient_id": "HBIN008055","Ingredient_name": "3\u03b2,21\u03b1-dihydroxyserrat-14-en-24-ol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6117","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β,21β-dihydroxyserrat-14-en-24-ol
{"Ingredient_id": "HBIN008060","Ingredient_name": "3\u03b2,21\u03b2-dihydroxyserrat-14-en-24-ol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC1(C(CCC2(C1CC=C3C2CCC4C(C3)(CCC5C4(CCC(C5(C)CO)O)C)C)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6119","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β,9α-dihydroxylanost-24-en-26-ol
{"Ingredient_id": "HBIN008121","Ingredient_name": "3\u03b2,9\u03b1-dihydroxylanost-24-en-26-ol","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC(CCC=C(C)C=O)C1CCC2(C1(CCC3(C2CCC4C3(CCC(C4(C)C)O)C)O)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5946","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
Abrisapogenol A
{"Ingredient_id": "HBIN014241","Ingredient_name": "Abrisapogenol A","Alias": "AC1NSSNX; abrisapogenolA; abrisapogenol a; 11-(hydroxymethyl)-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5O)(C)CO)C)C)C)C","Ingredient_weight": "458.7 g/mol","OB_score": "17.58247465","CAS_id": "NA","SymMap_id": "SMIT13981;SMIT14094","TCMID_id": "14;32825","TCMSP_id": "MOL013315","TCM_ID_id": "NA","PubChem_id": "20055693","DrugBank_id": "NA"}
Abrisapogenol D
{"Ingredient_id": "HBIN014244","Ingredient_name": "Abrisapogenol D","Alias": "abrisapogenol d","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5O)(C)CO)C)C)C)C","Ingredient_weight": "458.72","OB_score": "17.64046383","CAS_id": "10379-65-4","SymMap_id": "SMIT05696;SMIT14097","TCMID_id": "17","TCMSP_id": "MOL003657","TCM_ID_id": "NA","PubChem_id": "14335975","DrugBank_id": "NA"}
adian-5-ene ozonide
{"Ingredient_id": "HBIN014715","Ingredient_name": "adian-5-ene ozonide","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC(C)C1CCC2C1(CCC3(C2(CCC4(C3CC5OC6(C4CCCC6(C)C)OO5)C)C)C)C","Ingredient_weight": "458.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "630","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "14544123","DrugBank_id": "NA"}
altissimanins B
{"Ingredient_id": "HBIN015785","Ingredient_name": "altissimanins B","Alias": "NA","Ingredient_formula": "C30H50O3","Ingredient_Smile": "CC(CCC(C(C)(C)O)O)C1CCC2(C1(CCC3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32331","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}