Exact Mass: 458.3247
Exact Mass Matches: 458.3247
Found 500 metabolites which its exact mass value is equals to given mass value 458.3247
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
2-(Methoxycarbonyl)-5-methyl-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-5-(4-methyl-3-pentenyl)cyclohexanone
2-(Methoxycarbonyl)-5-methyl-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-5-(4-methyl-3-pentenyl)cyclohexanone is found in alcoholic beverages. 2-(Methoxycarbonyl)-5-methyl-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-5-(4-methyl-3-pentenyl)cyclohexanone is a constituent of Hypericum perforatum (St. Johns Wort) Constituent of Hypericum perforatum (St. Johns Wort). 2-(Methoxycarbonyl)-5-methyl-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-5-(4-methyl-3-pentenyl)cyclohexanone is found in tea, alcoholic beverages, and herbs and spices.
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one is found in herbs and spices. (3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one is a constituent of Muscari comosum (tassel hyacinth) Constituent of Muscari comosum (tassel hyacinth). (3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one is found in herbs and spices.
(3beta,5alpha,9alpha,22E,24R)-3,5,9-Trihydroxy-23-methylergosta-7,22-dien-6-one
(3beta,5alpha,9alpha,22E,24R)-3,5,9-Trihydroxy-23-methylergosta-7,22-dien-6-one is found in mushrooms. (3beta,5alpha,9alpha,22E,24R)-3,5,9-Trihydroxy-23-methylergosta-7,22-dien-6-one is a constituent of Lentinus edodes (shiitake) Constituent of Lentinus edodes (shiitake). (3beta,5alpha,9alpha,22E,24R)-3,5,9-Trihydroxy-23-methylergosta-7,22-dien-6-one is found in mushrooms.
Pubesenolide
Pubesenolide is found in fruits. Pubesenolide is a constituent of Physalis pubescens (ground cherry).
N-Eicosapentaenoyl Arginine
N-eicosapentaenoyl arginine belongs to the class of compounds known as N-acylamides. These are molecules characterized by a fatty acyl group linked to a primary amine by an amide bond. More specifically, it is an Eicosapentaenoic acid amide of Arginine. It is believed that there are more than 800 types of N-acylamides in the human body. N-acylamides fall into several categories: amino acid conjugates (e.g., those acyl amides conjugated with amino acids), neurotransmitter conjugates (e.g., those acylamides conjugated with neurotransmitters), ethanolamine conjugates (e.g., those acylamides conjugated to ethanolamine), and taurine conjugates (e.g., those acyamides conjugated to taurine). N-Eicosapentaenoyl Arginine is an amino acid conjugate. N-acylamides can be classified into 9 different categories depending on the size of their acyl-group: 1) short-chain N-acylamides; 2) medium-chain N-acylamides; 3) long-chain N-acylamides; and 4) very long-chain N-acylamides; 5) hydroxy N-acylamides; 6) branched chain N-acylamides; 7) unsaturated N-acylamides; 8) dicarboxylic N-acylamides and 9) miscellaneous N-acylamides. N-Eicosapentaenoyl Arginine is therefore classified as a long chain N-acylamide. N-acyl amides have a variety of signaling functions in physiology, including in cardiovascular activity, metabolic homeostasis, memory, cognition, pain, motor control and others (PMID: 15655504). N-acyl amides have also been shown to play a role in cell migration, inflammation and certain pathological conditions such as diabetes, cancer, neurodegenerative disease, and obesity (PMID: 23144998; PMID: 25136293; PMID: 28854168).N-acyl amides can be synthesized both endogenously and by gut microbiota (PMID: 28854168). N-acylamides can be biosynthesized via different routes, depending on the parent amine group. N-acyl ethanolamines (NAEs) are formed via the hydrolysis of an unusual phospholipid precursor, N-acyl-phosphatidylethanolamine (NAPE), by a specific phospholipase D. N-acyl amino acids are synthesized via a circulating peptidase M20 domain containing 1 (PM20D1), which can catalyze the bidirectional the condensation and hydrolysis of a variety of N-acyl amino acids. The degradation of N-acylamides is largely mediated by an enzyme called fatty acid amide hydrolase (FAAH), which catalyzes the hydrolysis of N-acylamides into fatty acids and the biogenic amines. Many N-acylamides are involved in lipid signaling system through interactions with transient receptor potential channels (TRP). TRP channel proteins interact with N-acyl amides such as N-arachidonoyl ethanolamide (Anandamide), N-arachidonoyl dopamine and others in an opportunistic fashion (PMID: 23178153). This signaling system has been shown to play a role in the physiological processes involved in inflammation (PMID: 25136293). Other N-acyl amides, including N-oleoyl-glutamine, have also been characterized as TRP channel antagonists (PMID: 29967167). N-acylamides have also been shown to have G-protein-coupled receptors (GPCRs) binding activity (PMID: 28854168). The study of N-acylamides is an active area of research and it is likely that many novel N-acylamides will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered for these molecules.
(2S)-6-Hydroxy-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecanoyl]-3,4-dihydrochromene-5-carbaldehyde
Platanic acid
A pentacyclic triterpenoid that is 30-norlupan-28-oic acid substituted by a 3beta-hydroxy and an oxo group at position 20. It is isolated from the leaves of Syzygium claviflorum and exhibits anti-HIV activity.
6alpha,18-dihydroxy-17-phenylacetoxy-kolav-3-en-15-ol
1-O-acetyl-2-O-[(3R)-3-(acetyloxy)octadecanoyl]-sn-glycerol
(2beta,6alpha,8alpha,9beta-10alpha,13alpha,14beta,17beta,18alpha,20beta,22beta)-2,6,22-trihydroxy-9,13-dimethyl-24,25,26,30-tetranorolean-4-ene-3,21-dione|2beta,6alpha,22beta-trihydroxy-24,29-dinor-D:A-friedoolean-4-ene-3,21-dione|6alpha-hydroxytriptocalline A
24-nor-3alpha,11alpha-dihydroxy-lup-20(29)-en-28-oic acid
2, 12-Dihydroxy-16-(2-hydroxy-5-methoxy-3-methylphenyl)-2, 6, 10, 14-tetramethyl-3, 10, 14-hexadecatrien-5-one
3alpha-(5-methyldodeca-2E,4E,6E-trienoyloxy)-9alpha,13-dihydroxy-10alphaH-eremophil-8-one-semi acetal|3alpha-<5-methyldodeca-2E,4E,6E-trienoyloxy>-9alpha,13-dihydroxy-10alphaH-eremophil-8-one-semi acetal
12alpha-acetoxy-22-hydroxy-24-methyl-24-oxoscalar-16-en-25-al|12alpha-acetoxy-24-methyl-24-oxoscalar-16-en-22,25-dial
(20R,22R)-22-(acetyloxy)-20-hydroxycholest-4-en-3-one|muricesteroid
12-deacetyl-23-acetoxy-20-methyl-12-epi-scalaradial
24xi-hydroperoxy-6beta-hydroxy-24-ethylcholesta-4,28(29)-dien-3-one
[(3R,5R,8R,9R,10R,13R,14R,17S)-4,4,8,10,14-pentamethyl-17-[(2S)-2-methyl-5-oxooxolan-2-yl]-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
28-Noroleana-16,21-diene-3alpha,19alpha,23,29-tetrol
6,9-di-sec-butyl-15-methoxy-12-methylamino-4,7,10-triaza-bicyclo[12.3.1]octadeca-1(18),2,14,16-tetraene-5,8,11-trione|Abyssinin-B
3-[(3R,4aR,6aR,7R,10aR,10bR)-6a,10b-dimethyl-3-(1-hydroxy-1-methylethyl)-8-(methylene)-perhydro-1H-benzo[f]chromen-7-yl]methyl-5,6-dimethyl-2-methoxy-4H-pyran-4-one|Candelalide C
(3alpha,5alpha),(7beta,11beta)-diepidioxy-ergost-22E-en-12-one
16beta-Acetoxy-24-methyl-12,24-dioxo-25-scalaranal
(2E,6E,14E)-1-(1hydroxy-4-methoxy-6-methyl-phenyl)-5,13-dihydroxy-12-one-3,7,11,15-tetramethylhexadeca-2,6,14-triene
(3??,21??)-3,21-Dihydroxy-30-nor-27-friedelanoic acid
9-sec-butyl-6-isobutyl-15-methoxy-12-methylamino-4,7,10-triaza-bicyclo[12.3.1]octadeca-1(18),2,14,16-tetraene-5,8,11-trione|Abyssenine A
20S,24-epoxy-25,26,27-trisnor-24-oxo-3,4-seco-4(28)-dammaren-3-carboxylic acid methyl ester
3beta,20xi-dihydroxy-30-norolean-12-en-28-oic acid
(3R,5aR,5bR,6R,7S,9S,11aR,12R,13bS)-icosahydro-5a,5b,11a,13b-tetramethyl-8-methylidene-3-(prop-1-en-2-yl)-1H-cyclopenta[a]chrysene-6,7,9,12-tetrol|21alphaH-24-norhopa-4(23),22(29)-diene-3beta,6beta,7beta,11alpha-tetrol|cavalerol A
12-epi-19-O-methylscalarin
A scalarane sesterterpenoid that is 12-epi-scalarin in which the hydorxy group at position 19 is replaced by a methoxy group. It has been isolated from the sponge, Hyattella species.
methyl 20S,24-epoxy-25,26,27-trisnor-24-oxo-3,4-seco-4(28)-dammaren-3-carboxylate
(+)-(3S,5S,7S,8S,13R,14S,17R,18R,19R,21S)-25-norfern-1(10),9-(11)-diene-3,7,19,28-tetraol
3,4-seco-29-nortirucalla-4,23-dione-7-ene-3-oic acid|aphanamgrandin G
(3beta,12beta,16beta)-3-hydroxy-12-acetoxy-24,25,26,27-tetranor-9,19-cycloart-23,16-olide|cimilactone C
27-demethyl-(E,E)-20(22),23-dien-3beta,6alpha,12beta-trihydroxydammar-25-one
(17R)-19(18?17)-abeo-2alpha,3alpha,23,24-tetrahydroxy-28-norolean-11,13-diene|stewertiisin C
(+)-(3S,7S,8S,13R,14S,17R,18R,19R,21S)-25-norfern-5(10),9(11)-diene-3,7,19,28-tetraol
5alpha-stigmasta-7,9(11),24(28)Z-triene-3beta,6beta,16b,2 9-tetrol
3alpha,24-dihydroxyolean-12-en-28-oic acid|scutellaric acid
stigma 5(6)-ene-7,22-dione-3beta,23beta-diol|triumfettosterol
cholesta-5,24-diene-1alpha,3beta,11alpha-triol 11-acetate
3beta,23,25-trihydroxy-24,28-epoxy-5alpha-stigmasta-8(9),14(15)-diene
(2E,6E,14E)-1-(1-hydroxy-4-methoxy-6-methylphenyl)-5,12-dihydroxy-13-one-3,7,11,15-tetramethyl hexadeca-2,6,14-triene|5, 12-Dihydroxy-16-(2-hydroxy-5-methoxy-3-methylphenyl)-2, 6, 10, 14-tetramethyl-2, 10, 14-hexadecatrien-4-one
2-ethoxycarbonyl-2-beta-hydroxy-A-nor-cholest-5-ene-4-one|2-ethoxycarbonyl-2beta-hydroxy-A-nor-cholesta-5-en-4-one
(2beta,3beta,4beta,20S)-20-(dimethylamino)-3-[(3-methylbut-2-enoyl)amino]-5alpha-pregn-16-ene-2,4-diol|Hookerianamide A
Sominone
Sominone is a natural product found in Withania somnifera with data available.
C28H42O5_3,5,9,23-Tetrahydroxy-18,22-cycloergosta-6,8(14)-dien-11-one
C29H46O4_3aH-Cyclopenta[a]chrysene-3a-carboxylic acid, 1-acetyleicosahydro-9-hydroxy-5a,5b,8,8,11a-pentamethyl-, (1R,3aS,5aR,5bR,9S,11aR)
Smilagenin acetate
Smilagenin acetate is a sapogenin derivative extracted from patent US20030004147A1. Smilagenin acetate increases the expression of acetylcholine m2 receptors and can be used for the research of dementia[1].
Ala Ile Lys Lys
Ala Ile Lys Gln
Ala Ile Gln Lys
Ala Lys Ile Lys
Ala Lys Ile Gln
Ala Lys Lys Ile
Ala Lys Lys Leu
Ala Lys Leu Lys
Ala Lys Leu Gln
Ala Lys Gln Ile
Ala Lys Gln Leu
Ala Leu Lys Lys
Ala Leu Lys Gln
Ala Leu Gln Lys
Ala Gln Ile Lys
Ala Gln Lys Ile
Ala Gln Lys Leu
Ala Gln Leu Lys
Gly Lys Arg Val
Gly Lys Val Arg
Gly Arg Lys Val
Gly Arg Val Lys
Gly Val Lys Arg
Gly Val Arg Lys
Ile Ala Lys Lys
Ile Ala Lys Gln
Ile Ala Gln Lys
Ile Ile Ile Thr
Ile Ile Leu Thr
Ile Ile Thr Ile
Ile Ile Thr Leu
Ile Lys Ala Lys
Ile Lys Ala Gln
Ile Lys Lys Ala
Ile Lys Gln Ala
Ile Leu Ile Thr
Ile Leu Leu Thr
Ile Leu Thr Ile
Ile Leu Thr Leu
Ile Gln Ala Lys
Ile Gln Lys Ala
Ile Thr Ile Ile
Ile Thr Ile Leu
Ile Thr Leu Ile
Ile Thr Leu Leu
Lys Ala Ile Lys
Lys Ala Ile Gln
Lys Ala Lys Ile
Lys Ala Lys Leu
Lys Ala Leu Lys
Lys Ala Leu Gln
Lys Ala Gln Ile
Lys Ala Gln Leu
Lys Gly Arg Val
Lys Gly Val Arg
Lys Ile Ala Lys
Lys Ile Ala Gln
Lys Ile Lys Ala
Lys Ile Gln Ala
Lys Lys Ala Ile
Lys Lys Ala Leu
Lys Lys Ile Ala
Lys Lys Leu Ala
Lys Lys Pro Ser
Lys Lys Ser Pro
Lys Leu Ala Lys
Lys Leu Ala Gln
Lys Leu Lys Ala
Lys Leu Gln Ala
Lys Asn Val Val
Lys Arg Gly Val
Lys Arg Val Gly
Lys Val Gly Arg
Lys Val Arg Gly
Leu Ala Lys Lys
Leu Ile Ile Thr
Leu Ile Leu Thr
Leu Ile Thr Ile
Leu Ile Thr Leu
Leu Lys Ala Lys
Leu Lys Lys Ala
Leu Leu Ile Thr
Leu Leu Leu Thr
Leu Leu Thr Ile
Leu Leu Thr Leu
Leu Thr Ile Ile
Leu Thr Ile Leu
Leu Thr Leu Ile
Leu Thr Leu Leu
Arg Gly Lys Val
Arg Gly Val Lys
Arg Lys Gly Val
Arg Lys Val Gly
Arg Val Gly Lys
Arg Val Lys Gly
Thr Ile Ile Ile
Thr Ile Ile Leu
Thr Ile Leu Ile
Thr Ile Leu Leu
Thr Leu Ile Ile
Thr Leu Ile Leu
Thr Leu Leu Ile
Thr Leu Leu Leu
Val Gly Lys Arg
Val Gly Arg Lys
Val Lys Gly Arg
Val Lys Arg Gly
Val Arg Gly Lys
Val Arg Lys Gly
18-acetoxy-1α-hydroxyvitamin D3 / 18-acetoxy-1α-hydroxycholecalciferol
18-acetoxy-25-hydroxyvitamin D3 / 18-acetoxy-25-hydroxycholecalciferol
(5Z,7E)-(1S,3R,11S)-11-[(1R)-oxiranyl]-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol
(5Z,7E)-(1S,3R)-26,27-dimethyl-20,21-methano-23-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanost-8-en-24-one
2-(Methoxycarbonyl)-5-methyl-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-5-(4-methyl-3-pentenyl)cyclohexanone
ascr#36
An (omega-1)-hydroxy fatty acid ascaroside obtained by formal condensation of the alcoholic hydroxy group of (19R)-19-hydroxyicosanoic acid with ascarylopyranose (the alpha anomer). It is a metabolite of the nematode Caenorhabditis elegans.
oscr#36
An omega-hydroxy fatty acid ascaroside obtained by formal condensation of the alcoholic hydroxy group of 20-hydroxyicosanoic acid (20-hydroxyarachidic acid) with ascarylopyranose (the alpha anomer). It is a metabolite of the nematode Caenorhabditis elegans.
18-acetoxy-1alpha-hydroxyvitamin D3
A hydroxycalciol that is calciol with an additional hydroxy group at position C-1 and an acetoxy group at C-18.
18-acetoxy-25-hydroxyvitamin D3
1alpha,25-dihydroxy-11alpha-[(1R)-oxiranyl]vitamin D3
1alpha,25-dihydroxy-11alpha-[(1S)-oxiranyl]vitamin D3
butane-1,4-diol,2,2-dimethylpropane-1,3-diol,hexanedioic acid,hexane-1,6-diol
Butanedioic acid, mono[2-hydroxy-3-[(1-oxooctadecyl)oxy]propyl]ester
Elacestrant
C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C1821 - Selective Estrogen Receptor Modulator C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C481 - Antiestrogen C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist C1892 - Chemopreventive Agent
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl oleate
20-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]eicosanoic acid
Fruticoside B
A steroid acid that is ergosta-7,24(28)-dien-21-oic acid substituted by hydroxy groups at positions 2 and 3 and a methyl group at position 5 (the 2alpha,3beta,4alpha,5alpha stereoisomer). It has been isolated from the roots of Breynia fruticosa.
(19R)-19-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]eicosanoic acid
(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Cabraleahydroxylactone acetate
A tetracyclic triterpenoid isolated from Aglaia abbreviata.
7-[(2E,5S,6S,7R,8R,10E,12R,13S)-5,6,7,13-tetrahydroxy-3,8,12-trimethyltetradeca-2,10-dienoyl]oxyheptanoic acid
7-[(E,5S,6S)-5,6-dihydroxy-6-[(2R,3R,5S)-5-[(2R,3S)-3-hydroxy-2-methylbutyl]-3-methyloxolan-2-yl]-3-methylhex-2-enoyl]oxyheptanoic acid
(2S)-6-Hydroxy-2,7,8-trimethyl-2-[(4R,8R)-4,8,12-trimethyltridecanoyl]-3,4-dihydrochromene-5-carbaldehyde
[3-Carboxy-2-(17-carboxyheptadecanoyloxy)propyl]-trimethylazanium
[3-carboxy-2-[3-[(E)-dec-4-enoyl]oxy-4-(trimethylazaniumyl)butanoyl]oxypropyl]-trimethylazanium
[3-Carboxy-2-[8-[3-(8-hydroxyoctyl)oxiran-2-yl]octanoyloxy]propyl]-trimethylazanium
candelalide C
A diterpenoid isolated from Sesquicillium candelabrum and has been shown to act as a blocker of the voltage-gated potassium channel Kv1.3.
Rel-2alpha,3beta,23-trihydroxy-19-oxo-18,19-seco-12,17-dien-28-norursane
A tetracyclic triterpenoid of the 8,19-seco-ursane-type skeleton isolated from the leaves of Rosa laevigata.
3beta,4beta,23-Trihydroxy-24,30-dinor-olean-12,20(29)-dien-28-oic acid
A natural product found in Paeonia rockii subspeciesrockii.
19-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-oxononadecanoic acid
(18R)-18-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-oxononadecanoic acid
(1R,3aS,5aR,5bR,9S,11aR)-1-acetyl-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
[(2R)-3-carboxy-2-(17-carboxyheptadecanoyloxy)propyl]-trimethylazanium
[1-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]-3-hydroxypropan-2-yl] butanoate
[1-hydroxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propan-2-yl] acetate
(1-hydroxy-3-propanoyloxypropan-2-yl) (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
[1-carboxy-3-[2-hydroxy-3-[(E)-pentadec-9-enoyl]oxypropoxy]propyl]-trimethylazanium
[1-carboxy-3-[2-hydroxy-3-[(Z)-pentadec-9-enoyl]oxypropoxy]propyl]-trimethylazanium
(3beta,5alpha,9alpha,22E,24R)-3,5,9-Trihydroxy-23-methylergosta-7,22-dien-6-one
LSKL, Inhibitor of Thrombospondin (TSP-1)
LSKL, Inhibitor of Thrombospondin (TSP-1) is a latency-associated protein (LAP)-TGFβ derived tetrapeptide and a competitive TGF-β1 antagonist. LSKL, Inhibitor of Thrombospondin (TSP-1) inhibits the binding of TSP-1 to LAP and alleviates renal interstitial fibrosis and hepatic fibrosis. LSKL, Inhibitor of Thrombospondin (TSP-1) suppresses subarachnoid fibrosis via inhibition of TSP-1-mediated TGF-β1 activity, prevents the development of chronic hydrocephalus and improves long-term neurocognitive defects following subarachnoid hemorrhage (SAH). LSKL, Inhibitor of Thrombospondin (TSP-1) can readily crosse the blood-brain barrier[1][2].
(3as,4ar,5r,6r,8ar,9s,9as)-9,9a-dihydroxy-4a,5-dimethyl-3-methylidene-octahydro-2h-naphtho[2,3-b]furan-6-yl (2e,4e,6e)-5-methyldodeca-2,4,6-trienoate
(1s,3as,5ar,9ar,9br,11as)-1-[(3s,5r,6s)-5,6-dihydroxy-7,7-dimethyloxepan-3-yl]-6,6,9a,11a-tetramethyl-1h,2h,3h,3ah,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-one
(10e,14e)-4,12-dihydroxy-16-(2-hydroxy-5-methoxy-3-methylphenyl)-2,6,10,14-tetramethylhexadeca-2,10,14-trien-5-one
2-butanoyl-3,5-dihydroxy-6-{2-[1-(hydroxymethyl)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalen-2-yl]ethyl}-4,4-dimethylcyclohexa-2,5-dien-1-one
7,9-dihydroxy-9a,11a-dimethyl-1-(6-methylhept-5-en-2-yl)-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-10-yl acetate
7-hydroxy-5-(14-hydroxy-14-methylpentadecyl)-2-(2-oxopropyl)chromen-4-one
15-(5,6-dimethylhept-3-en-2-yl)-5,10-dihydroxy-2-methyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-11-ene-16-carboxylic acid
4,12-dihydroxy-16-(2-hydroxy-5-methoxy-3-methylphenyl)-2,6,10,14-tetramethylhexadeca-2,10,14-trien-5-one
9b-hydroxy-9a,11a-dimethyl-1-(6-methylheptan-2-yl)-5-oxo-1h,2h,3h,3ah,5ah,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-yl acetate
2-{9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-2-hydroxy-6-methylheptan-3-yl acetate
3,13,17,27-tetramethyl-1,15-diazacyclooctacosa-3,5,7,9,11,17,19,21,23,25-decaene-2,16-dione
(4as,6as,6br,8ar,9s,10s,12ar,14bs)-9,10-dihydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid
(2r,3r)-2-[(1s,3as,3bs,9ar,9bs,11as)-9a,11a-dimethyl-7-oxo-1h,2h,3h,3ah,3bh,4h,5h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-hydroxy-6-methylheptan-3-yl acetate
(1s,3s,5s,6s,8r,9s,10s,13r,14r,17s,21s)-5,14-dimethyl-5-(4-methyl-3-methylidenepentyl)-2,4-dioxahexacyclo[11.8.0.0¹,⁹.0³,¹⁰.0⁶,¹⁰.0¹⁴,¹⁹]henicos-19-ene-8,17,21-triol
8-[3-(2,3-dimethylbutanoyl)-2-methylcyclopentyl]-3,6-dihydroxy-8,10b-dimethyl-1h,2h,3h,4h,5ah,6h,9h,10h-phenanthro[9,8a-b]oxiren-7-one
(2r,3as)-2-[(2s)-2-hydroxy-6-methylhept-5-en-2-yl]-5,5-dimethyl-3a-(3-methylbut-2-en-1-yl)-7-[(2r)-2-methylbutanoyl]-2,3-dihydro-1-benzofuran-4,6-dione
(1r,3s,3ar,5as,5bs,6s,9s,13ar,13br)-3a-(hydroxymethyl)-3-isopropyl-5a,8,8,13a-tetramethyl-1h,2h,3h,4h,5h,5bh,6h,7h,9h,10h,11h,13h,13bh-cyclopenta[a]chrysene-1,6,9-triol
methyl (1s,3r,4r,5s)-4-methyl-1,5-bis(3-methylbut-2-en-1-yl)-4-(4-methylpent-3-en-1-yl)-3-(2-methylpropanoyl)-2-oxocyclohexane-1-carboxylate
2-(2-hydroxy-6-methylhept-5-en-2-yl)-5,5-dimethyl-3a-(3-methylbut-2-en-1-yl)-7-(2-methylbutanoyl)-2,3-dihydro-1-benzofuran-4,6-dione
methyl 3-[(3s,3ar,5ar,6s,7s,9ar,9bs)-3a,6,9a,9b-tetramethyl-3-[(2r)-2-methyl-5-oxooxolan-2-yl]-7-(prop-1-en-2-yl)-octahydro-1h-cyclopenta[a]naphthalen-6-yl]propanoate
5-hydroxy-7-(1-hydroxypropan-2-ylidene)-1,8a-dimethyl-6-oxo-hexahydro-1h-naphthalen-2-yl 5-methyldodeca-2,4,6-trienoate
methyl (4r)-4-[(1r,3ar,4s,5ar,9as,11ar)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-1h,2h,3h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]pentanoate
(1r,3ar,5ar,6s,7s,9ar,9br,11ar)-6,7-dihydroxy-1-[(2r)-7-methoxy-6-methyl-5-methylideneheptan-2-yl]-9a,11a-dimethyl-1h,2h,3h,3ah,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-5-one
(9ar,11ar)-1-[(2r)-5-hydroperoxy-5-isopropylhept-6-en-2-yl]-5-hydroxy-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,5h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-one
(2r,3r,4s,6r)-6-methoxycarbonyl-3-methyl-4,6-di(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-3-(4-methyl-3-pentenyl)cyclohexanone
{"Ingredient_id": "HBIN006442","Ingredient_name": "(2r,3r,4s,6r)-6-methoxycarbonyl-3-methyl-4,6-di(3-methyl-2-butenyl)-2-(2-methyl-1-oxopropyl)-3-(4-methyl-3-pentenyl)cyclohexanone","Alias": "NA","Ingredient_formula": "C29H46O4","Ingredient_Smile": "CC(C)C(=O)C1C(=O)C(CC(C1(C)CCC=C(C)C)CC=C(C)C)(CC=C(C)C)C(=O)OC","Ingredient_weight": "458.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13868","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "91455395","DrugBank_id": "NA"}
3,4-dihydroxy-23-nor-12,20(29)-oleanadien-28-oic acid; (3β,4α)-form
{"Ingredient_id": "HBIN007372","Ingredient_name": "3,4-dihydroxy-23-nor-12,20(29)-oleanadien-28-oic acid; (3\u03b2,4\u03b1)-form","Alias": "NA","Ingredient_formula": "C29H46O4","Ingredient_Smile": "NA","Ingredient_weight": "458.67","OB_score": "NA","CAS_id": "211508-61-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8287","PubChem_id": "NA","DrugBank_id": "NA"}