Exact Mass: 364.2007
Exact Mass Matches: 364.2007
Found 500 metabolites which its exact mass value is equals to given mass value 364.2007
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Phorbol
Phorbol is a white solid. (NTP, 1992) Phorbol is a diterpenoid with the structure of tigliane hydroxylated at C-4, -9, -12(beta), -13 and -20, with an oxo group at C-3 and unsaturation at the 1- and 6-positions. It is a tetracyclic diterpenoid, an enone, a cyclic ketone, a tertiary alcohol and a tertiary alpha-hydroxy ketone. It derives from a hydride of a tigliane. Phorbol is a natural product found in Euphorbia tirucalli, Croton tiglium, and Rehmannia glutinosa with data available. Phorbol is a natural, plant-derived organic compound. It is a member of the tigliane family of diterpenes. Phorbol was first isolated in 1934 as the hydrolysis product of croton oil, which is derived from the seeds of the purging croton, Croton tiglium. The structure of phorbol was determined in 1967. It is very soluble in most polar organic solvents, as well as in water. Phorbol is a highly toxic diterpene, whose esters have important biological properties. Phorbol is a highly toxic diterpene, whose esters have important biological properties.
9-Fluoro-11beta,16alpha-dihydroxypregn-4-ene-3,20-dione
Cinncassiol C2
Cinncassiol C2 is found in herbs and spices. Cinncassiol C2 is a constituent of Cinnamomum cassia (Chinese cinnamon) Constituent of Cinnamomum cassia (Chinese cinnamon). Cinncassiol C2 is found in herbs and spices.
terpentecin
3b,9b-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide
3b,9b-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide is found in green vegetables. 3b,9b-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 3b,9a-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide is found in green vegetables.
3b-Hydroxy-6b-(2,3-epoxy-2-methylbutanoyloxy)-7(11)-eremophilen-12,8b-olide
3b-Hydroxy-6b-(2,3-epoxy-2-methylbutanoyloxy)-7(11)-eremophilen-12,8b-olide is found in green vegetables. 3b-Hydroxy-6b-(2,3-epoxy-2-methylbutanoyloxy)-7(11)-eremophilen-12,8b-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 3b-Hydroxy-6b-(2,3-epoxy-2-methylbutanoyloxy)-7(11)-eremophilen-12,8b-olide is found in green vegetables.
Blumealactone B
Blumealactone B is found in tea. Blumealactone B is a constituent of Blumea balsamifera (sambong). Constituent of Blumea balsamifera (sambong). Blumealactone B is found in tea.
3-(1,1-Dimethyl-2-propenyl)-8-(3-methyl-2-butenyl)xanthyletin
3-(1,1-Dimethyl-2-propenyl)-8-(3-methyl-2-butenyl)xanthyletin is found in herbs and spices. 3-(1,1-Dimethyl-2-propenyl)-8-(3-methyl-2-butenyl)xanthyletin is isolated from roots of Ruta graveolens (rue
3b,8a-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8-olide
3b,8a-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8-olide is found in green vegetables. 3b,8a-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 3b,8a-Dihydroxy-6b-tigloyloxy-7(11)-eremophilen-12,8-olide is found in green vegetables.
Gibberellin A74
Gibberellin A74 (GA74) belongs to the class of organic compounds known as C20-gibberellin 6-carboxylic acids. These are C20-gibberellins with a carboxyl group at the 6-position. Gibberellin A74 is found in fruits. Gibberellin A74 is a constituent of Cucurbita maxima. Constituent of Cucurbita maxima. Gibberellin A74 is found in winter squash, fruits, and japanese pumpkin.
Gibberellin A97
Gibberellin A97 (GA97) belongs to the class of organic compounds known as C20-gibberellin 6-carboxylic acids. These are C20-gibberellins with a carboxyl group at the 6-position. Gibberellin A97 is found in barley. Gibberellin A97 is a constituent of spinach (Spinacia oleracea). Constituent of spinach (Spinacia oleracea). Gibberellin A97 is found in many foods, some of which are orange mint, coriander, daikon radish, and peach (variety).
Eremopetasitenin A1
Eremopetasitenin B1 is found in green vegetables. Eremopetasitenin B1 is a constituent of Petasites japonicus (sweet coltsfoot)
Blumealactone A
Blumealactone A is found in tea. Blumealactone A is a constituent of Blumea balsamifera (sambong).
Gibberellin A100
Gibberellin A100 (GA100) belongs to the class of organic compounds known as C20-gibberellin 6-carboxylic acids. These are C20-gibberellins with a carboxyl group at the 6-position. Gibberellin A100 is found in fats and oils. Gibberellin A100 is a constituent of sunflower (Helianthus annuus) seeds. Constituent of sunflower (Helianthus annuus) seeds. Gibberellin A100 is found in sunflower and fats and oils.
Gibberellin A123
Gibberellin A123 (GA123) belongs to the class of organic compounds known as C20-gibberellin 6-carboxylic acids. These are C20-gibberellins with a carboxyl group at the 6-position. Gibberellin A123 is found in fruits. Gibberellin A123 is a constituent of strawberry (Fragaria x ananassa). Constituent of strawberry (Fragaria x ananassa). Gibberellin A123 is found in strawberry and fruits.
5-(4'-Hydroxyphenyl)-gamma-valerolactone-4'-O-glucuronide
5-(4-Hydroxyphenyl)-gamma-valerolactone-4-O-glucuronide is a conjugate of 5-(4-hydroxyphenyl)-gamma-valerolactone and glucuronide. A glucuronide, also known as glucuronoside, is any substance produced by linking glucuronic acid to another substance via a glycosidic bond. The glucuronides belong to the glycosides. (Wikipedia)
4alpha-Phorbol
Flugestone
Spirorenone
7-Methyl-2-morpholino-9-(1-(phenylamino)ethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Oridonin
Oridonin is an organic heteropentacyclic compound and ent-kaurane diterpenoid with formula C20H28O6 isolated from the leaves of the medicinal herb Rabdosia rubescens. It has a role as an antineoplastic agent, an angiogenesis inhibitor, an apoptosis inducer, an anti-asthmatic agent, a plant metabolite and an antibacterial agent. It is an organic heteropentacyclic compound, an enone, a cyclic hemiketal, a secondary alcohol and an ent-kaurane diterpenoid. Oridonin is a natural product found in Isodon rugosus, Isodon ternifolius, and other organisms with data available. An organic heteropentacyclic compound and ent-kaurane diterpenoid with formula C20H28O6 isolated from the leaves of the medicinal herb Rabdosia rubescens. Oridonin (NSC-250682), a diterpenoid isolated from Rabdosia rubescens, acts as an inhibitor of AKT, with IC50s of 8.4 and 8.9 μM for AKT1 and AKT2; Oridonin possesses anti-tumor, anti-bacterial and anti-inflammatory effects. Oridonin (NSC-250682), a diterpenoid isolated from Rabdosia rubescens, acts as an inhibitor of AKT, with IC50s of 8.4 and 8.9 μM for AKT1 and AKT2; Oridonin possesses anti-tumor, anti-bacterial and anti-inflammatory effects. Oridonin (NSC-250682), a diterpenoid isolated from Rabdosia rubescens, acts as an inhibitor of AKT, with IC50s of 8.4 and 8.9 μM for AKT1 and AKT2; Oridonin possesses anti-tumor, anti-bacterial and anti-inflammatory effects. Oridonin (NSC-250682), a diterpenoid isolated from Rabdosia rubescens, acts as an inhibitor of AKT, with IC50s of 8.4 and 8.9 μM for AKT1 and AKT2; Oridonin possesses anti-tumor, anti-bacterial and anti-inflammatory effects.
Lasiodonin
Lasiodonin is a natural product found in Isodon oresbius, Isodon parvifolius, and other organisms with data available.
Gibberellin A18
A C20-gibberellin, initially identified in Lupinus luteus, that is gibberellin A12 in which extra hydroxy substituents are present at the 2beta- and 7alpha-positions.
Decipienin G
2,3,3a,4,5,8,9,11a-Octahydro-6,10-bis(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid
Decipienin F
[4S-[4alpha,4abeta,5beta,6beta(2R*,3S*),8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-4,5-dihydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester 2,3-dimethyloxiranecarboxylic acid
3alpha,4beta,10beta-Trihydroxy-15,16-epoxy-cis-clerodane-13(16),14-dien-20,12-olide
[1S-[1alpha(E),3(E),5beta,6alpha]]-5-hydroxy-6-(1-methylethyl)-3-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]-4-oxo-2-cyclohexen-1-yl ester
Neurolenin A
A germacranolide isolated from Neurolaena lobata and Austroeupatorium inulifolium and has been shown to exhibit antimalarial activity.
2,3,3a,4,5,8,9,11a-Octahydro-5,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-butanoic acid
Decipienin D
N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-benzyl-1h-indazole-3-carboxamide
14,15-dihydroxy-8beta-isovaleryloxygermacra-1(10)E,4E-11(13)-trien-12,6alpha-olide
9-(2-Methylbutanoyl)-1(10)E,4beta,5alpha,6alpha,8alpha,9alpha)-4,5-Epoxy-8,9-dihydroxy-1(10),11(13)-germacradien-12,6-olide
1-Angeloyl-1,8,10-Trihydroxy-7(11)-eremophilen-12,8-olide
2,2-Dimethyl-7-(4-hydroxyphenethyl)-8-(3-methyl-2-butenyl)-2H-1-benzopyran-5-ol
blumealactone B
5-[2-(4-hydroxyphenyl)ethyl]-2,2-dimethyl-7-[(3-methyl-2-butenyl)oxy]chromene|xinjiastilbene A
1beta,4alpha-dihydroxy-8beta-tigloxy-11(13)-eudesmen-6alpha,12-olide
1H-2,8a-Methanocyclopenta[a]cyclopropa[e]cyclodecen-11-one, 1a,2,5,5a,6,9,10,10a-octahydro-5,5a,6-trihydroxy-1,4-bis(hydroxymethyl)-1,7,9-trimethyl-, [1S-(1.alpha.,1a.alpha.,2.alpha.,5.beta.,5a.beta.,6.beta.,8a.alpha.,9.alpha.,10a.alpha.)]-
6beta,7beta,12alpha,14beta-tetrahydroxy-7alpha,20-epoxy-ent-kaur-16-en-15-one|phyllostacin C
2alpha-isovaleryloxy-3,8-dioxo-11-hydroxy-4beta,5beta-epoxybisabola-8(14),9E-diene
9alpha,13R-15,16-bisepoxy-15alpha-hydroxy-3-oxo-labdan-6beta,19-olide
3beta-hydroxy-6beta-isobutyryloxy-8alpha-methoxyeremophil-1(10),7(11)-dien-12,8beta-olide
1-[3,4-dimethoxy-6-[(3,7-dimethyl-2,6-octadienyl)oxy]-2-hydroxyphenyl]-2-hydroxyethanone
10-Acetoxy-8,9-epoxy-7-isobutyryloxythymol isobutyrate
10-hydroxymethyl-9beta-hydroxy-8beta-(2-methylbutyryloxy)germacradien-6,7-olide
2alpha,10alpha,13alpha,17-tetrahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone|2??,10??,13??,17-Tetrahydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone
14-hydroxy-15-<2-methyl-3-hydroxybutyryloxy>-germacra-1(10)E,4Z,11(13)-trien-12,8alpha-olide|15-(2-methyl-3-hydroxy)butyryloxymicrantholide
8alpha-angeloyloxy-1beta-hydroxyarbusculin-4-O-methyl ether
10alpha-hydroxy-9alpha-isovaleryloxy-1alpha,4alpha-endoperoxyguaia-2,11(13)-dien-12,6alpha-olide
1alpha,7beta,10alpha,13alpha-tetrahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone
(Z,Z)-1,18-Diisothiocyanato-1,17-octadecadiene|(Z,Z)-1,18-diisothiocyanooctadeca-1,17-diene
(3aS,5aS,8R,10sS,10bR,11RS,13R,13aR)-decahydro-11,13-dihydroxy-1,1,7-trimethyl-5H-5a,8-methano-11H-cyclohepta[c]furo[3,4-e][1]benzopyran-5,6(7H)-dione|6beta,20RS-dihydroxy-16S-methyl-6,7-seco-6,20-epoxy-1alpha,7-olide-ent-kaur-15-one|phyllostacin B
16-(R)-methyl-3,6-epoxy-6,7:8,15-seco-7,20-olide-ent-kaur-15-oic acid|laxiflorin F
10alpha-hydroxy-9alpha-(2-methylbutyryloxy)-1alpha,4alpha-endoperoxyguaia-2,11(13)-dien-12,6alpha-olide
8alpha-angeloxy-14,15-dihydroxy-3(4),11(13)-germacradien-6,12-olide
Epinodosinol
(4S,8R,9R,12S,13S,14S,16R,18R)-9,14,18-trihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecan-2-one is a natural product found in Isodon angustifolius and Isodon sculponeatus with data available.
3alpha-angeloyloxy-5beta-tigloyloxy-7-hydroxycarvotacetone
6alpha-(2-methylbutyryloxy)-9beta-hydroxy-11alpha,13-dihydroaromaticin
3alpha,14-dihydroxy-8beta-tigloyloxy-6betaH,7alphaH,11alphaH-germacra-1(10)Z,4Z-dien-6,12-olide
7beta,9alpha,16-trihydroxy-8beta,20-epoxy-14alpha,15beta-cycloisopimara-6,20-dione|smardaesidin A
14beta-hydroxythessaline B|rel-(2aS,3R,4R,5R,7R,8aR)-decahydro-4-hydroxy-2a,5a,7-trimethyldispiro[furan-3,2-furan-5,6-naphtho[1,8-bc]furan]-2,5(2aH,4H)-dione
(+)-(3S,4S,5S,6S,7R,8S)-3,4-dihydroxy-8-(2-xi-methylbutyryloxy)guai-1(10),11(13)-dien-6,12-olide|argyinolide H
3beta,7alpha,14beta,18-tetrahydroxy-ent-kaur-16-ene-12,15-dione
20(S)-1alpha,7alpha,20-trihydroxy-6,15-dioxo-11beta,20-epoxy-8,15-seco-ent-kaur-16(17)-ene|rubescensin U
5,11beta,12beta-trihydroxy-15-oxo-ent-kaur-16-en-19-oic acid
4alpha,6alpha-dihydroxy-2alpha-angeloyloxy-pesudoguaia-11(13)-en-8alpha,12-olide|minimolide C
(1R,2S,7S)-1,2,7-trihydroxy-15-oxo-ent-kaur-16-en-19-oic acid|geopyxin E
1alpha-angeloyloxy-6beta,8beta-dihydroxyeremophil-7(11)-en-(12,8alpha)-olide|melanothyrsin B
(20S*)-1alpha,6beta,15beta,20beta-tetrahydroxy-11alpha,20-epoxy-ent-kaur-16-en-7-one|jianshirubesin E|rubescensin W
(E)-2,4-di(3-methyl-2-buten-1-yl)-3,4,5-trihydroxystilbene
10alpha,13alpha,16alpha,17-tetrahydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|10??,13??,16??,17-Tetrahydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
1alpha-angeloyloxy-10beta,8beta-dihydroxyeremophil-7(11)-en-8,12-olide|1alpha-angeloyloxy-8beta,10beta-dihydroxyeremophil-7(11)-en-8alpha,12-olide
2beta-<5-hydroxyangeloyloxy>-8beta-hydroxy-10beta-H-eremophilanolide
(8R,9beta)-2-[(angeloyl)oxy]-8,9-dihydroxyeremophil-7(11)-en-12,8-olide
6-(2-Methylbutanoyl)-2,6,9-Trihydroxy-1(10),4,11-germacratrien-12,8-olide
8alpha-hydroxy-9beta-isobutanoyloxy-4beta,5alpha-epoxy-trans-germacra-1(10)-en-12,6beta-olide
8beta-isovaleryloxy-10alpha-hydroxy-1-oxo-germacra-4E,11(13)-diene-12,6alpha-olide
10betaH,11betaH-1beta-angeloyloxy-7alpha,8alpha-epoxy-6beta-hydroxyeremophilan-12,8beta-olide|subspicatin E
(1(10)E,4beta)-8beta-(angeloyloxy)-6alpha,14,15-trihydroxygermarca-1(10),11(13)-diene-12-oic acid 12,6-lactone|(2Z)-2-methylbut-2-enoic acid (3aS,4R,6E,10R,11aR)-2,3,3a,4,5,8,9,10,11,11a-decahydro-6,10-bis(hydroxymethyl)-3-methylene-2-oxocyclobuta[b]furan-4-yl ester
3beta-angeloyloxy-4alpha,8beta-dihydroxy-eudesm-7(11)-en-8alpha,12-olide
1-hydroxy-3-angeloyloxy-11-hydroperoxyeremophila-6,9-dien-8-one
3beta-angeloyloxy-10beta-hydroxy-8-oxo-eremophil-6(7)-en-12-oic acid
11beta,13-dihydro 19-desoxycnicin|11beta,13-dihydro-19-desoxycnicin
(3beta,6beta,7alpha,11alpha)-7,20-epoxy-3,6,7,11-tetrahydroxykaur-16-en-15-one|taibaihenryiin B
1alpha,6beta,11beta-trihydroxy-7,17,20-trioxo-ent-abiata-15(16)-ene|rubescensin V
14-acetoxy-7alpha-angeloyloxy-6beta-hydroxyoplopan-8(10)-en-2-one
3beta,6beta,15alpha-trihydroxy-6,7-seco-6,20-epoxy-ent-kaur-16-en-1beta,7-olide|sculponeatin F
(3R*,3aR*,4S*,8S*,9R*,9aS*,9bS*)-2,3,3a,4,5,7,8,9,9a,9b-decahydro-8,9-dihydroxy-3,6,9-trimethyl-2-oxoazuleno[4,5-b]furan-4-yl (2Z)-2-methylbut-2-enoate|8alpha-(angelyloxy)-3beta,4beta-dihydroxy-5alphaH,6betaH,7alphaH,11alphaH-guai-1(10)-en-12,6-olide|indicumolide A
1alpha,3alpha-dihydroxy-2alpha(2-methylbutanoyloxy)-isoalantolactone
(4aR,5R,6S,8aS,9aR)-2,4,4a,5,6,7,8,8a,9,9a-decahydro-8a,9a-dihydroxy-3,4a,5-trimethyl-2-oxonaphtho[2,3-b]furan-6-yl 3-methylbut-2-enoate|8alpha,10beta-dihydroxy-3-[(3-methylbut-2-enoyl)oxy]eremophilenolide|hertidin A
2,2-Dimethyl-6-(3-methyl-2-butenyl)-7-(4-hydroxyphenethyl)-2H-1-benzopyran-5-ol
(6alpha,7beta,14beta)-6,7,14-Trihydroxy-18-vouacapanoic acid
(3alpha,5beta,6beta,9beta,10alpha,13alpha,14beta)-3,6,7,14-tetrahydroxy-7,20-epoxy-ent-kaur-16-en-15-one|phyllostacin F
3alpha4:18,19-diepoxy-18beta,19alpha-dihydroxy-cis-cleroda-13(14)-ene-15,16-olide
Anti-osteoporosis agent-2
effusanin E
C20H28O6_(2aS,5aR,7R,8aR)-6-Hydroxy-6-[2-(2-hydroxy-5-oxo-2,5-dihydro-3-furanyl)ethyl]-2a,5a,7-trimethyldecahydro-2H-naphtho[1,8-bc]furan-2-one
1,4,6-Trihydroxy-11(13)-eudesmen-12,8-olide 6-Tigloyl
Origin: Plant; SubCategory_DNP: Sesquiterpenoids
DODECAHYDRO-8-HYDROXY-1,2(5H)-FURAN-5,5-[5H-1,4A](METHANOXYMETHANO)NAPHTHALEN]-2,9-DIONE
3-(1,1-Dimethylallyl)-8-(3,3-dimethylallyl)xanthyletin
Eremopetasitenin A1
Blumealactone A
Gibberellin A74
3b,8a-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8-olide
3b,8b-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8-olide
3b,9b-Dihydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide
3b-Hydroxy-6b-(2,3-epoxy-2-methylbutanoyloxy)-7(11)-eremophilen-12,8b-olide
Gibberellin A97
Dracocephalumoid D
Ethyl 3-[2-[2-(dipropylamino)ethyl]-6-nitrophenyl]-2-oxopropanoate
6-Hydroxymethyl-[1,4]diazepane-1-carboxylic acid tert-butyl ester
1-Benzyl 4-tert-butyl 6-(hydroxymethyl)-1,4-diazepane-1,4-dicarboxylate
Methyl 4-[(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-naphthalenyl)carbonyl]benzoate
N-[(3R)-3-[[(1,1-Dimethylethoxy)carbonyl]amino]-1-oxobutyl]-N-(phenylmethyl)glycine methyl ester
5a,7a-Dimethyl-1,1a,5b,6,7,7a,8a,9,9a,9b,9c,9d-dodecahydrospiro[cyclopropa[4,5]cyclopenta[1,2-a]cyclopropa[l]phenanthrene-8,2-oxolane]-3,5(5aH)-dione
2-amino-6-[2-(cyclopropylmethoxy)-6-oxo-1-cyclohexa-2,4-dienylidene]-4-(4-piperidinyl)-1H-pyridine-3-carbonitrile
6alpha-Fluoro-11beta,17-dihydroxyprogesterone
(3S)-3-hydroxy-4-[[(2R)-1-(3-methylbutylamino)-1-oxo-4-phenylbutan-2-yl]amino]-4-oxobutanoic acid
(3S)-3-hydroxy-4-[[(2S)-1-(3-methylbutylamino)-1-oxo-4-phenylbutan-2-yl]amino]-4-oxobutanoic acid
6-cyclopropyl-N-[(2-methoxyphenyl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide
5,11-Dihydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
12,14-Dihydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
(3R,8R)-10-[(2R,5R)-3,5-Dihydroxy-6-methyloxan-2-yl]oxy-3,8-dihydroxyundecanoic acid
[(4R)-2-hydroxy-2-oxo-1,3,2lambda5-dioxaphospholan-4-yl]methyl tetradecanoate
2-[(2S)-2-[(1R)-2-[(1S,2S,4aS)-3-hydroxy-1,2,4a,5-tetramethyl-4-oxo-3,7,8,8a-tetrahydro-2H-naphthalen-1-yl]-1-hydroxyethyl]oxiran-2-yl]-2-oxoacetaldehyde
(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoyl]amino]hexanoic acid
cyclopropyl-[(2R,3R)-2-(hydroxymethyl)-3-phenyl-6-(5-pyrimidinylmethyl)-1,6-diazaspiro[3.3]heptan-1-yl]methanone
(1R,2S,6R,10S,11R,13R,14R,15R)-1,6,13,14-Tetrahydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyltetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dien-5-one
(1Z,3R)-N-[(5S)-6-(acetyloxy)-5-{(E)-[(3R)-1-hydroxy-3-isocyanobutylidene]amino}hexyl]-3-isocyanobutanimidic acid
(1R,4S,8R,9R,10R)-9-hydroxy-9-[2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]-4,8,10-trimethyl-2-oxatricyclo[6.3.1.04,12]dodecan-3-one
Gibberellin A37 open lactone
5-(4-Hydroxyphenyl)-gamma-valerolactone-4-O-glucuronide
3-(1,1-Dimethyl-2-propenyl)-8-(3-methyl-2-butenyl)xanthyletin
20-hydroxy-20-oxoleukotriene B4(2-)
A leukotriene anion that is the conjugate base of 20-hydroxy-20-oxoleukotriene B4 arising from deprotonation of the carboxylic acid functions; major species at pH 7.3.
1-Tetradecylglycerone 3-phosphate(2-)
A 1-alkylglycerone 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of 1-tetradecylglycerone 3-phosphate; major species at pH 7.3.
6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylbutanoate
(4s,4ar,4br,5s,7s,8ar,10s,10ar)-4,5,10-trihydroxy-1,1-dimethyl-9-oxo-7-(3-oxoprop-1-en-2-yl)-decahydro-2h-phenanthrene-4a-carbaldehyde
(1s,2s,5s,8r,9s,10s,11s,15s,18r)-9,10,15,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
7-hydroxy-5-[2-(5-hydroxy-2-oxo-5h-furan-3-yl)ethyl]-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
(4ar,5s,7r,8as,9as)-8a,9a-dihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-7-yl 2-methylbut-2-enoate
(1r,2s,4s,5r,7s,8r,9s,10s,13r)-2,7,8-trihydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
(1s,2s,4s,6r,7r,9r,13s,14r,16s,17s)-4,16-dihydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecane-3,11,15-trione
(1r,3s,5s,7e,9r,13s,15s)-9-hydroperoxy-5,9,13-trimethyl-18-methylidene-4,16-dioxatricyclo[13.3.0.0³,⁵]octadec-7-ene-14,17-dione
(1s,2r,3r,5r,9r,10r,11r)-10-hydroxy-5,9-dimethyl-14-methylidene-13-oxo-4,12-dioxatricyclo[9.3.0.0³,⁵]tetradecan-2-yl (2z)-2-methylbut-2-enoate
{7-hydroxy-8-methyl-3-methylidene-2,5-dioxo-octahydroazuleno[6,5-b]furan-4a-yl}methyl 3-methylbutanoate
5,6-dihydroxy-6-(hydroxymethyl)-2,12-dimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
13-methoxy-12-methyl-11-oxo-10,14-dioxapentacyclo[11.2.2.1¹,⁹.0²,⁷.0¹²,¹⁸]octadecan-6-yl acetate
(3ar,4r,6r,6ar,9r,9ar,9bs)-6,9-dihydroxy-6,9-dimethyl-3-methylidene-2,8-dioxo-octahydrocyclopenta[e]azulen-4-yl 2-methylpropanoate
6-ethenyl-4-hydroxy-5-(3-hydroxyprop-1-en-2-yl)-6-methyl-3-methylidene-2-oxo-tetrahydro-3ah-1-benzofuran-7-yl 2-methylbutanoate
4,7-dihydroxy-4a,8-dimethyl-3-methylidene-2-oxo-octahydro-3ah-azuleno[6,5-b]furan-5-yl 2-methylbut-2-enoate
9,10,15-trihydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
8a,9a-dihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-6-yl 3-methylbut-2-enoate
(1''r,3r,4''r,5r,5'r,6''r,8''s,12''r)-5-hydroxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-3,2':5',7''-[3]oxatricyclo[6.3.1.0⁴,¹²]dodecane]-2'',11''-dione
(3as,6r,10r,11r,11as)-10-hydroxy-6,10-dimethyl-3-methylidene-2,5-dioxo-octahydrocyclodeca[b]furan-11-yl (2z)-2-methylbut-2-enoate
8a,9a-dihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate
(1s,3as,4r,4'r,7r,7ar)-4'-ethenyl-7-hydroxy-4-(hydroxymethyl)-4,4',7a-trimethyl-3-oxo-3a,5,6,7-tetrahydrospiro[2-benzofuran-1,1'-cyclohexan]-2'-ene-2'-carboxylic acid
(1s,2s,5r,8s,9s,10s,11r,12s,15s)-9,10,15-trihydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(4s,4ar,5r,6s,8as,9r,9as)-6,9-dihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h,9ah-naphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
[(3as,4r,5s,6r,7ar)-6-ethenyl-4-hydroxy-3-methylidene-2-oxo-5-(prop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-6-yl]methyl (2r)-2-hydroxy-3-methylbutanoate
(1r,2s,3s,5s,8r,9r,10s,11r,18r)-3,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(1''r,2s,4''r,5r,5'r,6''r,8''s,12''r)-5-hydroxy-1'',6'',8''-trimethyldispiro[bis(oxolane)-2,2':5',7''-[3]oxatricyclo[6.3.1.0⁴,¹²]dodecane]-2'',11''-dione
(3s,3ar,5as,6r,9s,9ar,9br)-6,9-dihydroxy-3,5a,9-trimethyl-2-oxo-3ah,4h,5h,6h,9ah,9bh-naphtho[1,2-b]furan-3-yl 3-methylbut-2-enoate
1-(acetyloxy)-6-hydroxy-7-isopropyl-4-methylidene-2-oxo-hexahydro-1h-inden-5-yl 2-methylbut-2-enoate
5-[(1e)-2-{4-hydroxy-3-[(2,6,6-trimethylcyclohex-2-en-1-yl)methyl]phenyl}ethenyl]benzene-1,3-diol
(3r,3as,6s,7s,8s,8ar)-7-[(2e)-but-2-enoyl]-7-hydroxy-3,6-dimethyl-2-oxo-hexahydro-3h-cyclohepta[b]furan-8-yl (2e)-2-methylbut-2-enoate
(2s)-2-(2-hydroxypropan-2-yl)-5-(3-methylbut-2-en-1-yl)-4-[(1z)-2-phenylethenyl]-2,3-dihydro-1-benzofuran-6-ol
(1s,2r,4s,6r,8r,9r,11r)-8-hydroxy-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradecan-2-yl (2z)-2-methylbut-2-enoate
2,2-dimethyl-6-(3-methylbut-2-en-1-yl)-5-[(1e)-2-phenylethenyl]-3,4-dihydro-1-benzopyran-3,7-diol
{7,8-dihydroxy-3,6-dimethylidene-2-oxo-octahydro-3ah-azuleno[4,5-b]furan-9-yl}methyl 3-methylbutanoate
(3ar,4s,4as,5r,8r,8ar,9as)-5,8-dihydroxy-5,8a-dimethyl-3-methylidene-2-oxo-octahydronaphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
(2r)-2-[(3e)-4,8-dimethylnona-3,7-dien-1-yl]-2-methylpyrano[3,2-c]chromen-5-one
4'-ethenyl-7-hydroxy-4-(hydroxymethyl)-4,4',7a-trimethyl-3-oxo-3a,5,6,7-tetrahydrospiro[2-benzofuran-1,1'-cyclohexan]-2'-ene-2'-carboxylic acid
(3ar,4as,6s,7s,8r,8ar,9ar)-6,8-dihydroxy-8a-methyl-3,5-dimethylidene-2-oxo-octahydronaphtho[2,3-b]furan-7-yl 3-methylbutanoate
3,4,5-trihydroxy-5-(3-methylbut-2-en-1-yl)-4-(4-methylpent-3-enoyl)-2-(2-methylpropanoyl)cyclopent-2-en-1-one
(3ar,4s,4as,5r,7s,7as,8r,9as)-5,7-dihydroxy-4a,8-dimethyl-3-methylidene-2-oxo-octahydro-3ah-azuleno[6,5-b]furan-4-yl (2z)-2-methylbut-2-enoate
(1r,2r,3as,6s,8ar,10ar)-2,6-dihydroxy-1-isopropyl-8a,10a-dimethyl-3,4-dioxo-1h,2h,3ah,6h,7h,8h,9h,10h-cyclohexa[f]azulene-5-carboxylic acid
(1r,2s,5s,8r,9s,10s,11r,12s,18r)-9,10,18-trihydroxy-12-(hydroxymethyl)-12-methyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
3,15-dihydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecane-4,11,16-trione
(3ar,4s,4as,5s,8r,8ar,9as)-5,8-dihydroxy-5,8a-dimethyl-3-methylidene-2-oxo-octahydronaphtho[2,3-b]furan-4-yl 3-methylbut-2-enoate
(1r,2r,5s,7r,8r,9s,10s,11r,18r)-7,9,10,18-tetrahydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-16-one
2-[(2s)-2-[(acetyloxy)methyl]oxiran-2-yl]-5-[(2-methylpropoxy)methyl]phenyl 2-methylpropanoate
7-butoxy-12,14-dihydroxy-3-methyl-4,5,6,7,8,10-hexahydro-3h-2-benzoxacyclododecine-1,9-dione
2,6,8-trihydroxy-4-isopropyl-3,7,11-trimethyl-13-oxatetracyclo[5.5.3.0¹,⁸.0²,⁶]pentadec-3-ene-12,14-dione
13-oxyingenol
{"Ingredient_id": "HBIN001283","Ingredient_name": "13-oxyingenol","Alias": "NA","Ingredient_formula": "C20H28O6","Ingredient_Smile": "CC1CC2(C(C2(C)C)C3C=C(C(C4(C1(C3=O)C=C(C4O)C)O)O)CO)O","Ingredient_weight": "364.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT17060","TCMID_id": "16437","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "59053144","DrugBank_id": "NA"}
Amarolide
{"Ingredient_id": "HBIN015816","Ingredient_name": "Amarolide","Alias": "AIDS-026413; Picrasane-1,12,16-trione, 2,11-dihydroxy-, (2.alpha.,11.alpha.)-; (2alpha,11alpha)-2,11-Dihydroxypicrasane-1,12,16-trione; 29913-86-8; amarolide; AIDS026413; Picrasane-1,12,16-trione, 2,11-dihydroxy-, (2alpha,11alpha)-; (2.alpha.,11.alpha.)-2,11-Dihydroxypicrasane-1,12,16-trione","Ingredient_formula": "C20H28O6","Ingredient_Smile": "CC1CC(C(=O)C2(C1CC3C4(C2C(C(=O)C(C4CC(=O)O3)C)O)C)C)O","Ingredient_weight": "364.43","OB_score": "15.62679806","CAS_id": "29913-86-8","SymMap_id": "SMIT07953","TCMID_id": "1018","TCMSP_id": "MOL006310","TCM_ID_id": "NA","PubChem_id": "460539","DrugBank_id": "NA"}
amethystoicacid
{"Ingredient_id": "HBIN015847","Ingredient_name": "amethystoicacid","Alias": "NA","Ingredient_formula": "C20H28O6","Ingredient_Smile": "CC12CCCC(C1CC(C34C2CC(C(C3O)C(=C)C4=O)O)O)(C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1037","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anhydrocinnzeylanone
{"Ingredient_id": "HBIN016158","Ingredient_name": "anhydrocinnzeylanone","Alias": "NA","Ingredient_formula": "C20H28O6","Ingredient_Smile": "CC1CCC2(C3(CC(=O)OC2(C1=O)C4(C3(CC(=C4C)C(C)C)O)O)C)O","Ingredient_weight": "364.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1265","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "637209","DrugBank_id": "NA"}