Exact Mass: 348.2101
Exact Mass Matches: 348.2101
Found 500 metabolites which its exact mass value is equals to given mass value 348.2101,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Bexarotene
4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-vinyl]-benzoic acid
Bexarotene is only found in individuals that have used or taken this drug. It is an antineoplastic agent indicated by the FDA for Cutaneous T cell lymphoma. It has been used off-label for lung cancer, breast cancer, and Kaposis sarcoma (Wikipedia). Bexarotene selectively binds with and activates retinoid X receptor subtypes. There are three subtypes in total: RXRα, RXRβ, RXRγ. The exact mechanism of action of bexarotene in the treatment of CTCL is unknown but the drug has activity in all clinical stages of CTCL. L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01X - Other antineoplastic agents > L01XF - Retinoids for cancer treatment C274 - Antineoplastic Agent > C2122 - Cell Differentiating Agent > C1934 - Differentiation Inducer C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C804 - Retinoic Acid Agent C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent D000970 - Antineoplastic Agents
Roxatidine acetate
({3-[3-(piperidin-1-ylmethyl)phenoxy]propyl}carbamoyl)methyl acetate
Roxatidine acetate is only found in individuals that have used or taken this drug. It is a specific and competitive H2 receptor antagonist. It is currently approved in South Africa under the tradename Roxit.The H2 antagonists are competitive inhibitors of histamine at the parietal cell H2 receptor. They suppress the normal secretion of acid by parietal cells and the meal-stimulated secretion of acid. They accomplish this by two mechanisms: histamine released by ECL cells in the stomach is blocked from binding on parietal cell H2 receptors which stimulate acid secretion, and other substances that promote acid secretion (such as gastrin and acetylcholine) have a reduced effect on parietal cells when the H2 receptors are blocked. D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents
(R)-1-(5-Tert-Butyl-2,3-dihydro-1H-inden-1-yl)-3-(1H-indazol-4-yl)urea
(R)-1-(5-Tert-Butyl-2,3-dihydro-1H-inden-1-yl)-3-(1H-indazol-4-yl)urea
4-[2-(5,5,8,8-Tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzoic acid
4-[2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-en-1-yl]benzoic acid
Intoplicine
16-{[3-(dimethylamino)propyl]amino}-13-methyl-11,15-diazatetracyclo[8.7.0.0^{2,7}.0^{12,17}]heptadeca-1(10),2,4,6,8,12(17),13,15-octaen-5-ol
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C1748 - Topoisomerase Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent
bixin aldehyde
4,8,13,17-tetramethylicosa-2,4,6,8,10,12,14,16,18-nonaenedial
Bixin aldehyde is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Bixin aldehyde can be found in a number of food items such as bamboo shoots, sago palm, welsh onion, and globe artichoke, which makes bixin aldehyde a potential biomarker for the consumption of these food products.
Isolasolide
[3S-[3alpha(Z),3aalpha,5aalpha,6alpha,9abeta,9balpha]]-2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6-hydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid
1,10-Epoxy-4alpha-hydroxy-6beta-isovaleryloxyfuranoeremophilane
1,10-Epoxy-4alpha-hydroxy-6beta-isovaleryloxyfuranoeremophilane
Effusanin A
(1S,2S,5R,8S,9R,10S,11R,15S)-9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-7-one
(R)-2-(1,5-dimethyl-4-hexenyl)-4-hydroxy-5-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl ester 3-methylbutanoic acid
(R)-2-(1,5-dimethyl-4-hexenyl)-4-hydroxy-5-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl ester 3-methylbutanoic acid
Megathyrin A
Megathyrin A
A cyclic terpene ketone that is ent-7alpha,20-epoxy-kaur-16-en-15-one substituted with hydroxy groups at positions 1, 7 and 14 (the 1alpha,7beta,14beta stereoisomer). Isolated from the leaves of Isodon megathyrsus, it exhibits cytotoxic activity.
(E,Z,E,Z)-6-Formyl-2,10,14-trimethyl-2,6,10,14-hexadecatetraenedioic acid
(E,Z,E,Z)-6-Formyl-2,10,14-trimethyl-2,6,10,14-hexadecatetraenedioic acid
2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-7-hydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-8-yl ester 2-methylbutanoic acid
2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-7-hydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-8-yl ester 2-methylbutanoic acid
Sinularolide C
Sinularolide C
A cembrane diterpenoid that is an epimer of sinularolide B at C-3. Isolated from Sinularia gibberosa and has been found to exhibit antineoplastic activity.
(R)-5-(1,5-dimethyl-4-hexenyl)-4-hydroxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl ester 3-methylbutanoic acid
(R)-5-(1,5-dimethyl-4-hexenyl)-4-hydroxy-2-methyl-3,6-dioxo-1,4-cyclohexadien-1-yl ester 3-methylbutanoic acid
2(S)-7-Hydroxy-2-methyl-2-(4-methyl-3-pentenyl)-5-(2-phenylethyl)chromene
2(S)-7-Hydroxy-2-methyl-2-(4-methyl-3-pentenyl)-5-(2-phenylethyl)chromene
[4aR-[4aalpha,5alpha,6alpha(2S*,3R*),8abeta]]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester 2,3-dimethyloxiranecarboxylic acid
[4aR-[4aalpha,5alpha,6alpha(2S*,3R*),8abeta]]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester 2,3-dimethyloxiranecarboxylic acid
9-Acetoxy-8-hydroxy-1-methoxy-10-heptadecene-4,6-diyn-3-one
9-Acetoxy-8-hydroxy-1-methoxy-10-heptadecene-4,6-diyn-3-one
8beta-(2-Methylbutanoyl)-14-hydroxy-1(10),4E,11(13)-germacratrien-12,6beta-olide
8beta-(2-Methylbutanoyl)-14-hydroxy-1(10),4E,11(13)-germacratrien-12,6beta-olide
N-(1-Amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indazole-3-carboxamide
N-(1-Amino-3-methyl-1-oxobutan-2-yl)-1-(5-fluoropentyl)-1H-indazole-3-carboxamide
Cohumulone
3,4,5-Trihydroxy-2,4-bis(3-methyl-2-butenyl)-6-(2-methyl-1-oxopropyl)-2,5-cyclohexadien-1-one, 9ci
(2R,4S,5R,8R,9R,10R)-2-[(angeloyl)oxy]-9-hydroxyeremophil-7(11)-en-12,8-olide|(8R,9beta)-2-[(angeloyl)oxy]-9-hydroxyeremophil-7(11)-en-12,8-olide
(2R,4S,5R,8R,9R,10R)-2-[(angeloyl)oxy]-9-hydroxyeremophil-7(11)-en-12,8-olide|(8R,9beta)-2-[(angeloyl)oxy]-9-hydroxyeremophil-7(11)-en-12,8-olide
1alpha,10alpha,13alpha-trihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|1??,10??,13??-Trihydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
1alpha,10alpha,13alpha-trihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|1??,10??,13??-Trihydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
8alpha-<2-methylbutanoyloxy>-4beta,5alpha-epoxy-trans-germacra-1(10)-en-12,6beta-olide
8alpha-<2-methylbutanoyloxy>-4beta,5alpha-epoxy-trans-germacra-1(10)-en-12,6beta-olide
6beta,7beta,14beta-trihydroxy-9(10->20)-abeo-6,20-epoxy-ent-kaur-16-en-15-one|luanchunin A
6beta,7beta,14beta-trihydroxy-9(10->20)-abeo-6,20-epoxy-ent-kaur-16-en-15-one|luanchunin A
12,16,17-trihydroxy-abieta-8,11,13-trien-19-oic acid|12,16,17-Trihydroxy-abieta-8,11,13-trien-19-oic Acid, Pododacric Acid|12,16,17-Trihydroxy-abieta-8,11,13-trien-19-saeure|pododacric acid|Pododacric-saeure|Pododacrinsaeure
12,16,17-trihydroxy-abieta-8,11,13-trien-19-oic acid|12,16,17-Trihydroxy-abieta-8,11,13-trien-19-oic Acid, Pododacric Acid|12,16,17-Trihydroxy-abieta-8,11,13-trien-19-saeure|pododacric acid|Pododacric-saeure|Pododacrinsaeure
8-(2-Methylbutanoyl)-(1(10)E, 4E, 6alpha, 8beta, 9xi)-8, 9-Dihydroxy-1(10), 4, 11(13)-grmacratrien-12, 6-olide
8-(2-Methylbutanoyl)-(1(10)E, 4E, 6alpha, 8beta, 9xi)-8, 9-Dihydroxy-1(10), 4, 11(13)-grmacratrien-12, 6-olide
8alpha-(2-methylbutyryloxy)-9alpha-hydroxymontahibisciolide
8alpha-(2-methylbutyryloxy)-9alpha-hydroxymontahibisciolide
7alpha,11alpha-dihydroxy-14-oxo-13(12->11)abeo-abieta-8-en-12,16-olide|Micranthin C
7alpha,11alpha-dihydroxy-14-oxo-13(12->11)abeo-abieta-8-en-12,16-olide|Micranthin C
5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one, 1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-7b,9,9a-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-, [1aR-(1a.alpha.,1b.beta.,4a.alpha.,7a.alpha.,7b.alpha.,8.alpha.,9.beta.,9a.alpha.)]-
5H-Cyclopropa[3,4]benz[1,2-e]azulen-5-one, 1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-7b,9,9a-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-, [1aR-(1a.alpha.,1b.beta.,4a.alpha.,7a.alpha.,7b.alpha.,8.alpha.,9.beta.,9a.alpha.)]-
4beta-Hydroxy-4,5beta-dihydro-6-O-tigloylsteiractinolid
4beta-Hydroxy-4,5beta-dihydro-6-O-tigloylsteiractinolid
(+)-miliusane IX|6alpha-hydroxy-9beta-acetoxy-1beta-(2,6-dimethylhepta-1,5-dienyl)-2-oxa-spiro[4.5]dec-7-ene-3,6,9-trione
(+)-miliusane IX|6alpha-hydroxy-9beta-acetoxy-1beta-(2,6-dimethylhepta-1,5-dienyl)-2-oxa-spiro[4.5]dec-7-ene-3,6,9-trione
15-hydroxypinusolidic acid|15?鈥?Hydroxypinusolidic acid|16-hydroxylabda-8(17),13-diene-15,19-dioic acid butenolide
15-hydroxypinusolidic acid|15?鈥?Hydroxypinusolidic acid|16-hydroxylabda-8(17),13-diene-15,19-dioic acid butenolide
4alpha-hydroxy-2alpha-isovaleryloxy-10betaH-guaia-1(5)11(13)-dien-8alpha,12-olide
4alpha-hydroxy-2alpha-isovaleryloxy-10betaH-guaia-1(5)11(13)-dien-8alpha,12-olide
3,4-Dihydro-6,8-dihydroxy-3-(6-oxoundecyl)-1H-2-benzopyran-1-one
3,4-Dihydro-6,8-dihydroxy-3-(6-oxoundecyl)-1H-2-benzopyran-1-one
1alpha-tigloyloxy-8beta-hydroxyeremophil-7(11)-en-12,8alpha-olide
1alpha-tigloyloxy-8beta-hydroxyeremophil-7(11)-en-12,8alpha-olide
7beta,11beta,12beta-trihydroxy-ent-abieta-8(14),13(15)-dien-16,12-olide
7beta,11beta,12beta-trihydroxy-ent-abieta-8(14),13(15)-dien-16,12-olide
(3alpha,5beta,6beta,9beta,10alpha,13alpha)-3,6,7-trihydroxy-7,20-epoxy-ent-kaur-16-en-15-one|phyllostacin G
(3alpha,5beta,6beta,9beta,10alpha,13alpha)-3,6,7-trihydroxy-7,20-epoxy-ent-kaur-16-en-15-one|phyllostacin G
1beta,2beta-epoxy-3beta-(3-methylbutanoyloxy)-5betaH,6alphaH,7alphaH,10alphaMe,11alphaMe-eudesm-4(15)-en-6,12-olide
1beta,2beta-epoxy-3beta-(3-methylbutanoyloxy)-5betaH,6alphaH,7alphaH,10alphaMe,11alphaMe-eudesm-4(15)-en-6,12-olide
15xi-hydroxy-16-oxospongi-13-en-19-oic acid|spongiabutenolide A
15xi-hydroxy-16-oxospongi-13-en-19-oic acid|spongiabutenolide A
1-Angeloyl-1,10-Dihydroxy-7(11)-eremophilen-12,8-olide
1-Angeloyl-1,10-Dihydroxy-7(11)-eremophilen-12,8-olide
8-(2,3-Epoxy-3-methylbutanoyl)-8-Hydroxy-4-daucene-3,9-dione
8-(2,3-Epoxy-3-methylbutanoyl)-8-Hydroxy-4-daucene-3,9-dione
1-beta, 10beta-Epoxide, 6-(2-methylpropanoyl)-(4alpha, 6beta)-Furanoeremophil-1(10)-ene-4, 6-diol
1-beta, 10beta-Epoxide, 6-(2-methylpropanoyl)-(4alpha, 6beta)-Furanoeremophil-1(10)-ene-4, 6-diol
(4R,4aR)-4,4a-dihydroxy-3-hydroxymethyl-7,7,10a-trimethyl-2,4,4a,5,6,6a,7,8,9,10,10a,10b-dodecahydrophenanthro<3,2-b>furan-2-one|(4R,4aR)-4,4a-dihydroxy-3-hydroxymethyl-7,7,10a-trimethyl-2,4,4a,5,6,6a,7,8,9,10,10a,10b-dodecahydrophenanthro[3,2-b]furan-2-one|(ent-8beta,14alpha)-form-8,14,17-Trihydroxy-11,13(15)-abietadien-16,12-olide
(4R,4aR)-4,4a-dihydroxy-3-hydroxymethyl-7,7,10a-trimethyl-2,4,4a,5,6,6a,7,8,9,10,10a,10b-dodecahydrophenanthro<3,2-b>furan-2-one|(4R,4aR)-4,4a-dihydroxy-3-hydroxymethyl-7,7,10a-trimethyl-2,4,4a,5,6,6a,7,8,9,10,10a,10b-dodecahydrophenanthro[3,2-b]furan-2-one|(ent-8beta,14alpha)-form-8,14,17-Trihydroxy-11,13(15)-abietadien-16,12-olide
cis-ent-14,15-Epoxyclerod-3-en-16,18-dioic acid-16,15-olide
cis-ent-14,15-Epoxyclerod-3-en-16,18-dioic acid-16,15-olide
16-hydroxy-ent-cleroda-3,13-diene-17-oic acid-15,16-olide
16-hydroxy-ent-cleroda-3,13-diene-17-oic acid-15,16-olide
6beta,7beta-Dihydroxyleanon|7beta,6beta-dihydroxyroyleanone
6beta,7beta-Dihydroxyleanon|7beta,6beta-dihydroxyroyleanone
1alpha-senecioyloxy-10beta-hydroxyeremophil-7(11)-en-8alpha,12-olide
1alpha-senecioyloxy-10beta-hydroxyeremophil-7(11)-en-8alpha,12-olide
2beta-<5-hydroxyangeloyloxy>-10beta-H-eremophilanolide
2beta-<5-hydroxyangeloyloxy>-10beta-H-eremophilanolide
1alpha-hydroxy-6beta-(2xi-methylbutyryloxy)-10alphaH-9-oxofuranoeremophilane
1alpha-hydroxy-6beta-(2xi-methylbutyryloxy)-10alphaH-9-oxofuranoeremophilane
7beta-angeloyloxy-8alpha,9alpha-dihydroxylongipin-2-en-1-one
7beta-angeloyloxy-8alpha,9alpha-dihydroxylongipin-2-en-1-one
(3R*,3R*,3aS*,5R*,7S*,7aR*)-1,3,3a,4,5,6,7,7a-octahydro-3-hydroxy-4,7,7a-trimethyl-2-oxospiro[furan-3,2-inden]-5-yl (2Z)-2-methylbut-2-enoate|9-hydroxyisobakkenolide
(3R*,3R*,3aS*,5R*,7S*,7aR*)-1,3,3a,4,5,6,7,7a-octahydro-3-hydroxy-4,7,7a-trimethyl-2-oxospiro[furan-3,2-inden]-5-yl (2Z)-2-methylbut-2-enoate|9-hydroxyisobakkenolide
16-Hydroxy-8(17),13-labdadien-15,16-olid-19-oic acid
16-Hydroxy-8(17),13-labdadien-15,16-olid-19-oic acid
4-Hydroxy-2-isobutyryl-5-(3-methyl-but-2-enyl)-4-(4-methyl-pent-3-enoyl)-cyclopentan-1,3-dion|4-hydroxy-2-isobutyryl-5-(3-methyl-but-2-enyl)-4-(4-methyl-pent-3-enoyl)-cyclopentane-1,3-dione
4-Hydroxy-2-isobutyryl-5-(3-methyl-but-2-enyl)-4-(4-methyl-pent-3-enoyl)-cyclopentan-1,3-dion|4-hydroxy-2-isobutyryl-5-(3-methyl-but-2-enyl)-4-(4-methyl-pent-3-enoyl)-cyclopentane-1,3-dione
6,7-Epoxide-8alpha-8,14-Dihydroxy-1(19),6,10,12-xenicateteraen-18,17-olide
6,7-Epoxide-8alpha-8,14-Dihydroxy-1(19),6,10,12-xenicateteraen-18,17-olide
3beta,17,19-trihydroxyspongia-13(16),14-dien-2-one|3beta,17,19-Trihydroxyspongin-13(16),14-dien-2-on|Epispongiatriol
3beta,17,19-trihydroxyspongia-13(16),14-dien-2-one|3beta,17,19-Trihydroxyspongin-13(16),14-dien-2-on|Epispongiatriol
2alpha-Hydroxy-8beta-(2-methylbutyryloxy)costunolide
2alpha-Hydroxy-8beta-(2-methylbutyryloxy)costunolide
3-(2, 3-Epoxy-2-methylbutanoyl)-(3alpha, 4alpha)-Furanoeudesmane-3, 4-diol
3-(2, 3-Epoxy-2-methylbutanoyl)-(3alpha, 4alpha)-Furanoeudesmane-3, 4-diol
3-angeloyloxy-1,11-dihydroxyeremophila-6,9-dien-8-one
3-angeloyloxy-1,11-dihydroxyeremophila-6,9-dien-8-one
6beta,10alpha,13alpha-trihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone|6??,10??,13??-Trihydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone
6beta,10alpha,13alpha-trihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone|6??,10??,13??-Trihydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid (19,10)-lactone
5alpha-hydroxy-15-(2-methylbutyryloxy)-germacra-1(10)E,3Z,11(13)-trien-12,8alpha-olide
5alpha-hydroxy-15-(2-methylbutyryloxy)-germacra-1(10)E,3Z,11(13)-trien-12,8alpha-olide
(1alpha,7alpha,14beta)-1,7,14-trihydroxy-ent-kaur-16-en-15,18-dione|1a,7a,14b-1,7,14-trihydroxy-ent-kaur-16-15,18-dion|weisiensin B
(1alpha,7alpha,14beta)-1,7,14-trihydroxy-ent-kaur-16-en-15,18-dione|1a,7a,14b-1,7,14-trihydroxy-ent-kaur-16-15,18-dion|weisiensin B
(6beta,13alpha)-9-hydroxy-18-oxo-6,18-epoxypimar-7-en-16-oic acid|2-[ (3aR,5aS*,8R*,10aS*,10bR*,10cS*)-2,3,3a,4,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-4-oxo-1H-phenanthro[10,1-bc]furan-8-yl]acetic acid|xylarenolide
(6beta,13alpha)-9-hydroxy-18-oxo-6,18-epoxypimar-7-en-16-oic acid|2-[ (3aR,5aS*,8R*,10aS*,10bR*,10cS*)-2,3,3a,4,5a,7,8,9,10,10a,10b,10c-dodecahydro-10a-hydroxy-3a,8,10b-trimethyl-4-oxo-1H-phenanthro[10,1-bc]furan-8-yl]acetic acid|xylarenolide
2beta-angeloyloxy-8beta-hydroxy-10beta-H-eromophilanolide
2beta-angeloyloxy-8beta-hydroxy-10beta-H-eromophilanolide
10beta-hydroxy-8alpha-senecioyloxy-slov-3-en-6,12-olide
10beta-hydroxy-8alpha-senecioyloxy-slov-3-en-6,12-olide
(3R)-6,8-dihydroxy-3-(10-oxoundecyl)-3,4-dihydroisocoumarin
(3R)-6,8-dihydroxy-3-(10-oxoundecyl)-3,4-dihydroisocoumarin
(2R)-2-Hydroxy-4-isobutyryl-2,6-bis-(3-methyl-but-2-enyl)-cyclohexan-1,3,5-trion|(2R)-2-hydroxy-4-isobutyryl-2,6-bis-(3-methyl-but-2-enyl)-cyclohexane-1,3,5-trione
(2R)-2-Hydroxy-4-isobutyryl-2,6-bis-(3-methyl-but-2-enyl)-cyclohexan-1,3,5-trion|(2R)-2-hydroxy-4-isobutyryl-2,6-bis-(3-methyl-but-2-enyl)-cyclohexane-1,3,5-trione
15-isovaleryloxy-4beta,5alpha-epoxygermacra-1(10)E,11(13)-dien-12,8alpha-olide
15-isovaleryloxy-4beta,5alpha-epoxygermacra-1(10)E,11(13)-dien-12,8alpha-olide
6alpha,11,12,16-tetrahydroxy-7-oxoabieta-8,11,13-triene|6alpha,11,12,16-tetrahydroxyabieta-8,11,13-trien-7-one|Nellionol
6alpha,11,12,16-tetrahydroxy-7-oxoabieta-8,11,13-triene|6alpha,11,12,16-tetrahydroxyabieta-8,11,13-trien-7-one|Nellionol
4-epi-henryine A|4-Epihenryin A|4-Epihenryine|amethystoidin A|henryin A
4-epi-henryine A|4-Epihenryin A|4-Epihenryine|amethystoidin A|henryin A
6alpha,15-dihydroxy-7,13-abietadien-12-oxo-18-oic acid|pinyunin B
6alpha,15-dihydroxy-7,13-abietadien-12-oxo-18-oic acid|pinyunin B
(ent-3??, 4??)-form-15, 16-Epoxy-3, 4-dihydroxy-12-oxo-13(16), 14-clerodadien-20-al|3alpha,4beta-dihydroxy-15,16-epoxy-12-oxo-cleroda-13(16),14-dien-9-al|3??,4??-Dihydroxy-15,16-epoxy-12-oxo-cleroda-13(16),14-dien-9-oal
(ent-3??, 4??)-form-15, 16-Epoxy-3, 4-dihydroxy-12-oxo-13(16), 14-clerodadien-20-al|3alpha,4beta-dihydroxy-15,16-epoxy-12-oxo-cleroda-13(16),14-dien-9-al|3??,4??-Dihydroxy-15,16-epoxy-12-oxo-cleroda-13(16),14-dien-9-oal
7alpha,9alpha,12alpha-trihydroxy-6beta,20-epoxyisopimara-8(14),15-dien-20-one|smardaesidin E
7alpha,9alpha,12alpha-trihydroxy-6beta,20-epoxyisopimara-8(14),15-dien-20-one|smardaesidin E
(2E,4S)-8-[(5R)-1,3,4,5,6,7-hexahydro-1-hydroxy-4,4-dimethyl-3-oxo-2-benzofuran-5-yl]-4-hydroxy-2-methyl-6-methylideneoct-2-enal|cespitulin F
(2E,4S)-8-[(5R)-1,3,4,5,6,7-hexahydro-1-hydroxy-4,4-dimethyl-3-oxo-2-benzofuran-5-yl]-4-hydroxy-2-methyl-6-methylideneoct-2-enal|cespitulin F
3-deacetyl-11-oxoleukamenin E|3beta,7alpha,14beta-trihydroxy-ent-kaur-16-ene-11,15-dione
3-deacetyl-11-oxoleukamenin E|3beta,7alpha,14beta-trihydroxy-ent-kaur-16-ene-11,15-dione
6beta,14beta,15beta-trihydroxy-11alpha,20-epoxy-ent-kaur-16-en-7-one|jianshirubesin F
6beta,14beta,15beta-trihydroxy-11alpha,20-epoxy-ent-kaur-16-en-7-one|jianshirubesin F
10alpha,13alpha,17-trihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|10??,13??,17-Trihydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
10alpha,13alpha,17-trihydroxy-9alpha-methyl-15-oxo-20-nor-kauran-19-oic acid gamma-lactone|10??,13??,17-Trihydroxy-9??-methyl-15-oxo-20-nor-kauran-19-oic acid ??-lactone
6beta,15alpha-dihydroxy-6,7-seco-6,20-epoxy-1alpha,7-olide-ent-kaur-16-ene|6beta,15alpha-dihydroxy-6alpha,20-epoxy-6,7-seco-ent-kaur-16-en-1alpha,7-olide|isodocarpin
6beta,15alpha-dihydroxy-6,7-seco-6,20-epoxy-1alpha,7-olide-ent-kaur-16-ene|6beta,15alpha-dihydroxy-6alpha,20-epoxy-6,7-seco-ent-kaur-16-en-1alpha,7-olide|isodocarpin
(1S,7S)-1,7-dihydroxy-15-oxo-ent-kaur-16-en-19-oic acid|geopyxin A
(1S,7S)-1,7-dihydroxy-15-oxo-ent-kaur-16-en-19-oic acid|geopyxin A
6|A-Hydroxycleroda-3,13-dien-16,15-olid-18-oic acid
6|A-Hydroxycleroda-3,13-dien-16,15-olid-18-oic acid
1alpha-angeloyloxy-6beta-hydroxyeremophil-7(11)-en-(12,8alpha)-olide|melanothyrsin A
1alpha-angeloyloxy-6beta-hydroxyeremophil-7(11)-en-(12,8alpha)-olide|melanothyrsin A
3,16-dioxo-3-methoxy-2,3-secoandrostane 2,19-lactone
3,16-dioxo-3-methoxy-2,3-secoandrostane 2,19-lactone
2alpha,3beta,11,12-tetrahydroxy-7beta,20-epoxy-8,11,13-abietatriene
2alpha,3beta,11,12-tetrahydroxy-7beta,20-epoxy-8,11,13-abietatriene
6beta,15xi-dihydroxy-7-oxo-8,13-labdadien-15,16-olide|isosibiricinone B
6beta,15xi-dihydroxy-7-oxo-8,13-labdadien-15,16-olide|isosibiricinone B
15,16-epoxy-6beta,9alpha-dihydroxylabda-13(16),14-dien-3,7-dione
15,16-epoxy-6beta,9alpha-dihydroxylabda-13(16),14-dien-3,7-dione
4E-9beta-angeloyloxy-2alpha-hydroxy-7alpha,10alphaH-germacra-4,11(13)-dien-12,6alpha-olide
4E-9beta-angeloyloxy-2alpha-hydroxy-7alpha,10alphaH-germacra-4,11(13)-dien-12,6alpha-olide
ent-18-acetoxy-7alpha,14beta-dihydroxykaur-16-en-15-one
ent-18-acetoxy-7alpha,14beta-dihydroxykaur-16-en-15-one
3beta,6-dihydroxy-6,7-seco-ent-kaur-16-en-15-one-7,20-olide|sculponin T
3beta,6-dihydroxy-6,7-seco-ent-kaur-16-en-15-one-7,20-olide|sculponin T
9-<3-methylvaleryloxy>-trans-7,8-epoxyanol isovalerate
9-<3-methylvaleryloxy>-trans-7,8-epoxyanol isovalerate
(+)-(1R,3S,5S,6S,7S,10R)-1-hydroxy-3-isovaleroyloxyeudesman-4 (15),11(13)-dien-6,12-olide|argyinolide J
(+)-(1R,3S,5S,6S,7S,10R)-1-hydroxy-3-isovaleroyloxyeudesman-4 (15),11(13)-dien-6,12-olide|argyinolide J
3-oxo-11alpha-hydroxyleukamenin E|7alpha,11alpha,14beta-trihydroxyent-kaur-16-ene-3,15-dione
3-oxo-11alpha-hydroxyleukamenin E|7alpha,11alpha,14beta-trihydroxyent-kaur-16-ene-3,15-dione
(ent-6alpha,11alpha)-6,11-Dihydroxy-15-oxo-16-kauren-19-oic acid
(ent-6alpha,11alpha)-6,11-Dihydroxy-15-oxo-16-kauren-19-oic acid
ent-6|A,9|A-Dihydroxy-15-oxokaur-16-en-19-oic acid
ent-6|A,9|A-Dihydroxy-15-oxokaur-16-en-19-oic acid
2alpha-hydroxy-8beta-tigloyloxy-11beta,13H-germacra-1(10)E.4E-dien-12.6alpha-olide
2alpha-hydroxy-8beta-tigloyloxy-11beta,13H-germacra-1(10)E.4E-dien-12.6alpha-olide
2,7,7,10-Tetramethyl-4-pentyl-7H-benzo[c]furo[2,3-f]chromene #
2,7,7,10-Tetramethyl-4-pentyl-7H-benzo[c]furo[2,3-f]chromene #
3alpha,4:18,19-diepoxy-19-hydroxy-cis-cleroda-13(14)-ene-15,16-olide
3alpha,4:18,19-diepoxy-19-hydroxy-cis-cleroda-13(14)-ene-15,16-olide
2-hydroperoxysarcophine|rel-(1aR,4E,11E,14aR)-2,3,6,7,10a,13,14,14a-octahydro-10a-hydroperoxy-1a,5,8,12-tetramethyloxireno[9,10]cyclotetradeca[1,2-b]furan-9(1aH)-one
2-hydroperoxysarcophine|rel-(1aR,4E,11E,14aR)-2,3,6,7,10a,13,14,14a-octahydro-10a-hydroperoxy-1a,5,8,12-tetramethyloxireno[9,10]cyclotetradeca[1,2-b]furan-9(1aH)-one
9-(2-methylbutanoyl) (1(10)E,4E,6alpha,8alpha,9alpha)--6,9-Dihydroxy-1(10),4,11(13)-germacratrien-12,8-olide
9-(2-methylbutanoyl) (1(10)E,4E,6alpha,8alpha,9alpha)--6,9-Dihydroxy-1(10),4,11(13)-germacratrien-12,8-olide
6R,7R-Epoxide-(1(9)E,4S,6E,10R)-4-Hydroxy-19-oxo-1(9),6,13-xenicatrien-18,17-olide
6R,7R-Epoxide-(1(9)E,4S,6E,10R)-4-Hydroxy-19-oxo-1(9),6,13-xenicatrien-18,17-olide
8S,12S-epoxy-7R,16-dihydroxyhalima-5(10),13-dien-15,16-olide|ent-8S,12S-Epoxy-7R,16-dihydroxyhalima-5(10),13-dien-15,16-olide
8S,12S-epoxy-7R,16-dihydroxyhalima-5(10),13-dien-15,16-olide|ent-8S,12S-Epoxy-7R,16-dihydroxyhalima-5(10),13-dien-15,16-olide
2-(3,7-dimethylocta-2,6-dienyl)-5-(2-phenylethenyl)benzene-1,3-diol
2-(3,7-dimethylocta-2,6-dienyl)-5-(2-phenylethenyl)benzene-1,3-diol
2alpha-hydroxy-9beta-O-methylbutanoyl-1(10),4,11(13)-germacratrien, 6alpha,12-olide
2alpha-hydroxy-9beta-O-methylbutanoyl-1(10),4,11(13)-germacratrien, 6alpha,12-olide
(2abeta,3alpha,5abeta,6beta,7alpha,8aalpha)-6-[2-(3-furanyl)ethyl]-2a,3,4,5,5a,6,7,8,8a,8b-decahydro-2a,3-dihydroxy-6,7,8b-trimethyl-2H-naphtho[1,8-bc]furan-2-one
(2abeta,3alpha,5abeta,6beta,7alpha,8aalpha)-6-[2-(3-furanyl)ethyl]-2a,3,4,5,5a,6,7,8,8a,8b-decahydro-2a,3-dihydroxy-6,7,8b-trimethyl-2H-naphtho[1,8-bc]furan-2-one
9-isovaleryloxy-trans-7,8-epoxyanol-<3-methylvalerate>
9-isovaleryloxy-trans-7,8-epoxyanol-<3-methylvalerate>
9alpha,16xi-dihydroxy-6-oxo-7,13-labdadien-15,16-olide|solicanolide
9alpha,16xi-dihydroxy-6-oxo-7,13-labdadien-15,16-olide|solicanolide
5alpha-hydroxy-15-isovaleryloxy-germacra-1(10)E,3Z,11(13)-trien-12,8alpha-olide
5alpha-hydroxy-15-isovaleryloxy-germacra-1(10)E,3Z,11(13)-trien-12,8alpha-olide
1alpha-hydroxy-3alpha(2-methylbutanoyloxy)-isoalantolactone
1alpha-hydroxy-3alpha(2-methylbutanoyloxy)-isoalantolactone
1alpha-hydroxy-6beta-isovaleryloxy-10alphaH-9-oxofuranoeremophilane
1alpha-hydroxy-6beta-isovaleryloxy-10alphaH-9-oxofuranoeremophilane
9-(3-methylbutanoyl)-(1(10)E,4E,6alpha,8alpha,9alpha)-6,9-Dihydroxy-1(10),4,11(13)-germacratrien-12,8-olide
9-(3-methylbutanoyl)-(1(10)E,4E,6alpha,8alpha,9alpha)-6,9-Dihydroxy-1(10),4,11(13)-germacratrien-12,8-olide
8beta-(2-methylbutyryloxy)-14-oxo-11beta,13-dihydroacanthospermolide|8beta-<2-methylbutyryloxy>-14-oxo-11beta,13-dihydroacanthospermolide
8beta-(2-methylbutyryloxy)-14-oxo-11beta,13-dihydroacanthospermolide|8beta-<2-methylbutyryloxy>-14-oxo-11beta,13-dihydroacanthospermolide
14,15-Dihydro,14-oxo-8,20-Dihydroxy-14-serrulaten-19-oic acid|8,20-dihydroxy-14-oxo-serrulatan-19-oic acid
14,15-Dihydro,14-oxo-8,20-Dihydroxy-14-serrulaten-19-oic acid|8,20-dihydroxy-14-oxo-serrulatan-19-oic acid
7-Hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-5-(2-phenylethyl)-2H-1-benzopyran
7-Hydroxy-2-methyl-2-(4-methyl-3-penten-1-yl)-5-(2-phenylethyl)-2H-1-benzopyran
4beta-Hydroxy-4,5-beta-dihydro-6-O-senecioylsteiractinolid
4beta-Hydroxy-4,5-beta-dihydro-6-O-senecioylsteiractinolid
11beta-acetoxy-5alpha-propionyloxy-silphinen-3-one
11beta-acetoxy-5alpha-propionyloxy-silphinen-3-one
9alpha-(2-methylbutyryloxy)-desacetyl laurenobiolide
9alpha-(2-methylbutyryloxy)-desacetyl laurenobiolide
4-Deoxy-4α-phorbol
5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-one, 1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-7b,9,9a-trihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-, (1aR-(1aalpha,1bbeta,4aalpha,7aalpha,7balpha,8aalpha,9beta,9aalpha))-
15-Hydroxypinusolidic acid
(1R,4aS,5R,8aS)-5-[2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Bexarotene
4-[1-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-vinyl]-benzoic acid
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01X - Other antineoplastic agents > L01XF - Retinoids for cancer treatment C274 - Antineoplastic Agent > C2122 - Cell Differentiating Agent > C1934 - Differentiation Inducer C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C804 - Retinoic Acid Agent C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent D000970 - Antineoplastic Agents CONFIDENCE standard compound; INTERNAL_ID 501; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6073; ORIGINAL_PRECURSOR_SCAN_NO 6071 CONFIDENCE standard compound; INTERNAL_ID 501; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6096; ORIGINAL_PRECURSOR_SCAN_NO 6094 CONFIDENCE standard compound; INTERNAL_ID 501; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6097; ORIGINAL_PRECURSOR_SCAN_NO 6096 CONFIDENCE standard compound; INTERNAL_ID 501; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6100; ORIGINAL_PRECURSOR_SCAN_NO 6095 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3295
C20H28O5_2(5H)-Furanone, 3-[2-[(1R,4aS,5R,6R,8aS)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]acetyl]
NCGC00381207-01_C20H28O5_2(5H)-Furanone, 3-[2-[(1R,4aS,5R,6R,8aS)-decahydro-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]acetyl]-
C20H28O5_2-(3-Furyl)-7,8-dihydroxy-6a,7,10b-trimethyldodecahydro-4H-benzo[f]isochromen-4-one
NCGC00380451-01_C20H28O5_2-(3-Furyl)-7,8-dihydroxy-6a,7,10b-trimethyldodecahydro-4H-benzo[f]isochromen-4-one
C20H28O5_2(3H)-Furanone, 5-[4-[1-(acetyloxy)-4-oxo-5-[(2Z)-2-penten-1-yl]-2-cyclopenten-1-yl]butyl]dihydro
NCGC00380913-01_C20H28O5_2(3H)-Furanone, 5-[4-[1-(acetyloxy)-4-oxo-5-[(2Z)-2-penten-1-yl]-2-cyclopenten-1-yl]butyl]dihydro-
C20H28O5_Gibbane-1,10-dicarboxylic acid, 2-hydroxy-1,4a-dimethyl-8-methylene-, (1alpha,2beta,4aalpha,4bbeta,10beta)
NCGC00380833-01_C20H28O5_Gibbane-1,10-dicarboxylic acid, 2-hydroxy-1,4a-dimethyl-8-methylene-, (1alpha,2beta,4aalpha,4bbeta,10beta)-
C20H28O5_7,10-Methano-1H-benzocycloundecene-4-carboxylic acid, 2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-14-hydroxy-4,13a-dimethyl-9,13-dioxo-, methyl ester, (4R,4aS,10R,13aR)
NCGC00380426-01_C20H28O5_7,10-Methano-1H-benzocycloundecene-4-carboxylic acid, 2,3,4,4a,5,6,9,10,11,12,13,13a-dodecahydro-14-hydroxy-4,13a-dimethyl-9,13-dioxo-, methyl ester, (4R,4aS,10R,13aR)-
Tobramycin ion source fragment BCX, ring A fission
Tobramycin ion source fragment BCX, ring A fission
Roxane
({3-[3-(piperidin-1-ylmethyl)phenoxy]propyl}carbamoyl)methyl acetate
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents
3b-Hydroxy-6b-angeloyloxy-7(11)-eremophilen-12,8b-olide
6-hydroxy-3,4a,5-trimethyl-2-oxo-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-4-yl (2Z)-2-methylbut-2-enoate
Bakkenolide C
1-hydroxy-3a,4-dimethyl-4-methylidene-2-oxo-octahydrospiro[indene-2,3-oxolane]-7-yl (2E)-2-methylbut-2-enoate
3b-Hydroxy-6b-tigloyloxy-7(11)-eremophilen-12,8b-olide
6-hydroxy-3,4a,5-trimethyl-2-oxo-2H,4H,4aH,5H,6H,7H,8H,8aH,9H,9aH-naphtho[2,3-b]furan-4-yl (2E)-2-methylbut-2-enoate
WE 20:6;O3
(1S,2E,10R)-10-acetyl-3-methyl-7-methylidene-6-oxocyclodec-2-en-1-yl (2E)-4-hydroxy-4-methylpent-2-enoate
bhas#18
3R-hydroxy-10R-(3R,5R-dihydroxy-6S-methyl-(2H)-tetrahydropyran-2-yloxy)-undecanoic acid
An (omega-1)-hydroxy fatty acid ascaroside that is ascr#18 in which the pro-R hydrogen that is beta to the carboxy group is replaced by a hydroxy group. It is a metabolite of the nematode Caenorhabditis elegans as well as the sour paste nematode, Panagrellus redivivus.
bhos#18
3R-hydroxy-11-(3R,5R-dihydroxy-6S-methyl-(2H)-tetrahydropyran-2-yloxy)-undecanoic acid
An omega-hydroxy fatty acid ascaroside that is oscr#18 in which the pro-R hydrogen beta to the carboxy group is replaced by a hydroxy group. It is a metabolite of the nematode Caenorhabditis elegans.
(2R,5R,8R,9S,10R)-2alpha-hydroxy-cleroda-3,13-dien-16,15-olide-18-oic acid
(2R,5R,8R,9S,10R)-2alpha-hydroxy-cleroda-3,13-dien-16,15-olide-18-oic acid
(2R,5R,8R,9S,10R)-2beta-hydroxy-cleroda-3,13-dien-16,15-olide-18-oic acid
(2R,5R,8R,9S,10R)-2beta-hydroxy-cleroda-3,13-dien-16,15-olide-18-oic acid
Gibberellin A53
Gibberellin A53
A C20-gibberellin, initially identified in Vicia faba, that is gibberellin A12 in which a hydroxy substituent is present at the 7alpha- position.
Gibberellin A15
(1R,4aR,4bR,7R,9aR,10S,10aS)-4a-(hydroxymethyl)-1-methyl-8-methylenedodecahydro-1H-7,9a-methanobenzo[a]azulene-1,10-dicarboxylic acid
BENZYL 4-((TERT-BUTOXYCARBONYL)(METHYL)AMINO)PIPERIDINE-1-CARBOXYLATE
BENZYL 4-((TERT-BUTOXYCARBONYL)(METHYL)AMINO)PIPERIDINE-1-CARBOXYLATE
(S)-2-(DIBENZYLAMINO)-5-(1H-PYRROL-1-YL)PENTAN-2-OL
(S)-2-(DIBENZYLAMINO)-5-(1H-PYRROL-1-YL)PENTAN-2-OL
6-(tert-Butyloxycarbonyl-methylamino)-5-methylpyridine-3-boronic acid pinacol ester
6-(tert-Butyloxycarbonyl-methylamino)-5-methylpyridine-3-boronic acid pinacol ester
4-(carboxy-p-tolyl-methyl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester
4-(carboxy-p-tolyl-methyl)-[1,4]diazepane-1-carboxylic acid tert-butyl ester
Carpindolol
Carpindolol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist
tert-Butyl 2-((3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)amino)acetate
tert-Butyl 2-((3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)amino)acetate
TERT-BUTYL 4-(((BENZYLOXY)CARBONYL)AMINO)-4-METHYLPIPERIDINE-1-CARBOXYLATE
TERT-BUTYL 4-(((BENZYLOXY)CARBONYL)AMINO)-4-METHYLPIPERIDINE-1-CARBOXYLATE
CARBAMIC ACID, [TRANS-4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]CYCLOHEXYL]-, PHENYLMETHYL ESTER
CARBAMIC ACID, [TRANS-4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]CYCLOHEXYL]-, PHENYLMETHYL ESTER
Methyl 1-Benzyl-4-(Boc-amino)piperidine-4-carboxylate
Methyl 1-Benzyl-4-(Boc-amino)piperidine-4-carboxylate
5-(4-Nitrosopiperazin-1-yl)-2,2-diphenylpentanenitrile
5-(4-Nitrosopiperazin-1-yl)-2,2-diphenylpentanenitrile
benzyl 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]piperidine-1-carboxylate
benzyl 3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]piperidine-1-carboxylate
Urea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-cyclopentyl-N-phenyl- (9CI)
Urea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-cyclopentyl-N-phenyl- (9CI)
1-Benzyl 4-(2-methyl-2-propanyl) (5R)-5-methyl-1,4-diazepane-1,4-dicarboxylate
1-Benzyl 4-(2-methyl-2-propanyl) (5R)-5-methyl-1,4-diazepane-1,4-dicarboxylate
(6aS,10aR)-6,6,9-trimethyl-3-phenethyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol
(6aS,10aR)-6,6,9-trimethyl-3-phenethyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol
Benzene, 1-[(trans,trans)-4-ethenyl[1,1-bicyclohexyl]-4-yl]-4-ethoxy-2,3-difluoro-
Benzene, 1-[(trans,trans)-4-ethenyl[1,1-bicyclohexyl]-4-yl]-4-ethoxy-2,3-difluoro-
Iferanserin
Iferanserin
C78272 - Agent Affecting Nervous System > C66885 - Serotonin Antagonist Iferanserin (S-MPEC) is a selective 5-HT receptor (serotonin receptor) antagonist with an affinity for 5-HT2A receptor. Iferanserin has the potential for internal hemorrhoid disease treatment[1].
Pyrazolo(4,3:6,7)cyclohepta(1,2-b)pyrrolo(2,3-f)indol-9(2H)-one, 8-ethyl-4,5,6,8,10,12-hexahydro-3,10,10-trimethyl
Pyrazolo(4,3:6,7)cyclohepta(1,2-b)pyrrolo(2,3-f)indol-9(2H)-one, 8-ethyl-4,5,6,8,10,12-hexahydro-3,10,10-trimethyl
(Z)-4-(2-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)benzoic acid
(Z)-4-(2-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)benzoic acid
(3R,10R)-10-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxyundecanoic acid
(3R,10R)-10-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxyundecanoic acid
(3R)-11-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxyundecanoic acid
(3R)-11-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxyundecanoic acid
9alpha-Fluoro-11beta-hydroxy-4-pregnene-3,20-dione
9alpha-Fluoro-11beta-hydroxy-4-pregnene-3,20-dione
7-[(4-Ethyl-1-piperazinyl)-(3-pyridinyl)methyl]-8-quinolinol
7-[(4-Ethyl-1-piperazinyl)-(3-pyridinyl)methyl]-8-quinolinol
N-(4-fluorophenyl)-2-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]acetamide
N-(4-fluorophenyl)-2-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]acetamide
21-Fluoro-11-hydroxy-pregn-4-ene-3,20-dione, (11beta)-
21-Fluoro-11-hydroxy-pregn-4-ene-3,20-dione, (11beta)-
9-Fluoro-17beta-hydroxy-6alpha,17-dimethylandrost-4-ene-3,11-dione
9-Fluoro-17beta-hydroxy-6alpha,17-dimethylandrost-4-ene-3,11-dione
(4R,5E,7Z,12S,14Z)-4,12-Dihydroxy-9-oxo-5,7,10,14-prostatetren-1-oic acid
(4R,5E,7Z,12S,14Z)-4,12-Dihydroxy-9-oxo-5,7,10,14-prostatetren-1-oic acid
(4R)-3,4,5-Trihydroxy-4,6-bis(3-methyl-2-butenyl)-2-(2-methylpropanoyl)-2,5-cyclohexadien-1-one
(4R)-3,4,5-Trihydroxy-4,6-bis(3-methyl-2-butenyl)-2-(2-methylpropanoyl)-2,5-cyclohexadien-1-one
1-[(2-methyl-1H-indol-3-yl)-(2-pyridinyl)methyl]-4-piperidinecarboxamide
1-[(2-methyl-1H-indol-3-yl)-(2-pyridinyl)methyl]-4-piperidinecarboxamide
4-methyl-N-[1-[2-(1-pyrrolidinyl)ethyl]-2-benzimidazolyl]benzamide
4-methyl-N-[1-[2-(1-pyrrolidinyl)ethyl]-2-benzimidazolyl]benzamide
6alpha-Fluoro-17beta-hydroxyandrost-4-en-3-one acetate
6alpha-Fluoro-17beta-hydroxyandrost-4-en-3-one acetate
2-[(1S,3S,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1S,3S,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1S,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1S,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3S,4aS,9aR)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
2-[(1R,3S,4aS,9aR)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-propylacetamide
cyclopentyl-[(1S,5R)-7-[4-(5-pyrimidinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
cyclopentyl-[(1S,5R)-7-[4-(5-pyrimidinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
9-(2-O-methyl-alpha-L-rhamnosyloxy)nonanehydrazide
9-(2-O-methyl-alpha-L-rhamnosyloxy)nonanehydrazide
(2R,3S,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-2-hydroxy-3-[(Z)-2-hydroxyethenoxy]cyclohexyl]oxyoxan-3-ol
(2R,3S,5R,6R)-5-amino-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-2-hydroxy-3-[(Z)-2-hydroxyethenoxy]cyclohexyl]oxyoxan-3-ol
[3-(3-Acetyloxy-2-butanoyloxypropoxy)-1-carboxypropyl]-trimethylazanium
[3-(3-Acetyloxy-2-butanoyloxypropoxy)-1-carboxypropyl]-trimethylazanium
[1-Carboxy-3-[2,3-di(propanoyloxy)propoxy]propyl]-trimethylazanium
[1-Carboxy-3-[2,3-di(propanoyloxy)propoxy]propyl]-trimethylazanium
Intoplicine
Intoplicine
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C1748 - Topoisomerase Inhibitor C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent
bixin dialdehyde
bixin dialdehyde
An apo carotenoid that is the dialdehyde obtained by reduction of the terminal methyl ester and carboxy groups of bixin.
BDP9066
BDP9066
BDP9066 is a potent and selective myotonic dystrophy-related Cdc42-binding kinase MRCK inhibitor with an IC50 of 64 nM for MRCKβ in SCC12 cells, Ki values of 0.0136 nM and 0.0233 nM for MRCKα/β in house determinations, respectively. BDP9066 has therapeutic effect on skin cancer by reducing substrate phosphorylation.
(1s,3s,7r,13s,14s,15r,16r)-13,14-dihydroxy-6-(1-hydroxypropan-2-yl)-3,15-dimethyl-12-oxatetracyclo[8.5.1.0³,⁷.0¹³,¹⁶]hexadeca-5,9-dien-11-one
(1s,3s,7r,13s,14s,15r,16r)-13,14-dihydroxy-6-(1-hydroxypropan-2-yl)-3,15-dimethyl-12-oxatetracyclo[8.5.1.0³,⁷.0¹³,¹⁶]hexadeca-5,9-dien-11-one
(1s,2s,3s,4r,8s,9s,11s)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1s,2s,3s,4r,8s,9s,11s)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1r,2s,3s,4r,8s,9s,11r)-11-hydroxy-4,8-dimethyl-12-methylidenetetracyclo[9.2.2.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1r,2s,3s,4r,8s,9s,11r)-11-hydroxy-4,8-dimethyl-12-methylidenetetracyclo[9.2.2.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1r,9r,12s,14r)-9,13,13-trimethyl-3-(2-phenylethyl)-8-oxatetracyclo[7.4.1.0²,⁷.0¹²,¹⁴]tetradeca-2,4,6-trien-5-ol
(1r,9r,12s,14r)-9,13,13-trimethyl-3-(2-phenylethyl)-8-oxatetracyclo[7.4.1.0²,⁷.0¹²,¹⁴]tetradeca-2,4,6-trien-5-ol
(4s,4ar,5r,8as)-5-hydroxy-3,4a,5-trimethyl-9-oxo-4h,6h,7h,8h,8ah-naphtho[2,3-b]furan-4-yl 3-methylbutanoate
(4s,4ar,5r,8as)-5-hydroxy-3,4a,5-trimethyl-9-oxo-4h,6h,7h,8h,8ah-naphtho[2,3-b]furan-4-yl 3-methylbutanoate
(1s,4r,5s,6s,9s,10r,12r,14r)-4,5,6-trihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyltetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-15-one
(1s,4r,5s,6s,9s,10r,12r,14r)-4,5,6-trihydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyltetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-15-one
4-hydroxy-5-methyl-2-[(2r)-6-methylhept-5-en-2-yl]-3,6-dioxocyclohexa-1,4-dien-1-yl 3-methylbutanoate
4-hydroxy-5-methyl-2-[(2r)-6-methylhept-5-en-2-yl]-3,6-dioxocyclohexa-1,4-dien-1-yl 3-methylbutanoate
(1r,2s,5s,8r,9r,11r,15s,18s)-9,15,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(1r,2s,5s,8r,9r,11r,15s,18s)-9,15,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
2,3-dihydroxy-5,9-dimethyl-14-methylidene-12-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
2,3-dihydroxy-5,9-dimethyl-14-methylidene-12-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
(3s,3's,3'ar,5's,7'r,7'as)-3'-hydroxy-4,7',7'a-trimethyl-2-oxo-3',3'a,4',5',6',7'-hexahydro-1'h-spiro[furan-3,2'-inden]-5'-yl (2z)-2-methylbut-2-enoate
(3s,3's,3'ar,5's,7'r,7'as)-3'-hydroxy-4,7',7'a-trimethyl-2-oxo-3',3'a,4',5',6',7'-hexahydro-1'h-spiro[furan-3,2'-inden]-5'-yl (2z)-2-methylbut-2-enoate
8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate
8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate
4-hydroxy-1,5-dimethyl-9-oxo-8-oxatetracyclo[8.3.1.0²,⁶.0⁷,¹¹]tetradec-5-en-12-yl 3-methylbutanoate
4-hydroxy-1,5-dimethyl-9-oxo-8-oxatetracyclo[8.3.1.0²,⁶.0⁷,¹¹]tetradec-5-en-12-yl 3-methylbutanoate
11-hydroxy-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-8-yl 3-methylbutanoate
11-hydroxy-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-8-yl 3-methylbutanoate
(3s,3ar,4ar,5s,6r,9ar)-5-hydroxy-3,5,8-trimethyl-2-oxo-3h,3ah,4h,4ah,6h,7h,7ah,9ah-azuleno[6,5-b]furan-6-yl (2e)-2-methylbut-2-enoate
(3s,3ar,4ar,5s,6r,9ar)-5-hydroxy-3,5,8-trimethyl-2-oxo-3h,3ah,4h,4ah,6h,7h,7ah,9ah-azuleno[6,5-b]furan-6-yl (2e)-2-methylbut-2-enoate
(4ar,5r,6s,8as,9as)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-6-yl (2z)-2-methylbut-2-enoate
(4ar,5r,6s,8as,9as)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-6-yl (2z)-2-methylbut-2-enoate
(1r,5s,7s,10r)-1-(2,6-dimethylhepta-1,5-dien-1-yl)-10-hydroxy-3-oxo-2-oxaspiro[4.5]dec-8-en-7-yl acetate
(1r,5s,7s,10r)-1-(2,6-dimethylhepta-1,5-dien-1-yl)-10-hydroxy-3-oxo-2-oxaspiro[4.5]dec-8-en-7-yl acetate
(3bs,5ar,6s,7s,9ar,9br)-7-hydroxy-3b,6-bis(hydroxymethyl)-6,9a-dimethyl-4h,5h,5ah,7h,9h,9bh,10h,11h-phenanthro[1,2-c]furan-8-one
(3bs,5ar,6s,7s,9ar,9br)-7-hydroxy-3b,6-bis(hydroxymethyl)-6,9a-dimethyl-4h,5h,5ah,7h,9h,9bh,10h,11h-phenanthro[1,2-c]furan-8-one
4-hydroxy-9a-(3-hydroxyprop-1-en-2-yl)-6-isopropyl-3a,5a-dimethyl-3h,4h,5h,6h,7h-azuleno[5,6-b]furan-2,8-dione
4-hydroxy-9a-(3-hydroxyprop-1-en-2-yl)-6-isopropyl-3a,5a-dimethyl-3h,4h,5h,6h,7h-azuleno[5,6-b]furan-2,8-dione
2,16-dihydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
2,16-dihydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-5-carboxylic acid
6-hydroxy-14-isopropyl-7,13-dimethyl-5-methylidene-3,10-dioxatetracyclo[11.3.0.0²,⁶.0⁷,¹¹]hexadecane-9,16-dione
6-hydroxy-14-isopropyl-7,13-dimethyl-5-methylidene-3,10-dioxatetracyclo[11.3.0.0²,⁶.0⁷,¹¹]hexadecane-9,16-dione
(1s,2s,5r,6r,8r,11r,12r)-6-hydroxy-6-(hydroxymethyl)-2,12-dimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
(1s,2s,5r,6r,8r,11r,12r)-6-hydroxy-6-(hydroxymethyl)-2,12-dimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
(1r,2s,3's,3'ar,4's,5s)-1,3'a,4'-trimethyl-3-oxo-3',4',5',6'-tetrahydro-1'h-4,6-dioxaspiro[bicyclo[3.1.0]hexane-2,2'-inden]-3'-yl (2r)-2-methylbutanoate
(1r,2s,3's,3'ar,4's,5s)-1,3'a,4'-trimethyl-3-oxo-3',4',5',6'-tetrahydro-1'h-4,6-dioxaspiro[bicyclo[3.1.0]hexane-2,2'-inden]-3'-yl (2r)-2-methylbutanoate
(4as,10as)-5,6,8-trihydroxy-7-[(2s)-2-hydroxypropyl]-1,1,4a-trimethyl-3,4,10,10a-tetrahydro-2h-phenanthren-9-one
(4as,10as)-5,6,8-trihydroxy-7-[(2s)-2-hydroxypropyl]-1,1,4a-trimethyl-3,4,10,10a-tetrahydro-2h-phenanthren-9-one
(1r,2r,4ar,8ar)-1-[(3z)-3-carboxy-3-(2-oxoethylidene)propyl]-1,4a,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-2-carboxylic acid
(1r,2r,4ar,8ar)-1-[(3z)-3-carboxy-3-(2-oxoethylidene)propyl]-1,4a,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-2-carboxylic acid
9,15,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
9,15,18-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
9-hydroxy-4,8,10-trimethyl-9-[2-(5-oxo-2h-furan-3-yl)ethyl]-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-3-one
9-hydroxy-4,8,10-trimethyl-9-[2-(5-oxo-2h-furan-3-yl)ethyl]-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-3-one
(1s,4r,6r,7s,12r,13s,16r,18r)-6,18-dihydroxy-8,8-dimethyl-17-methylidene-3,5-dioxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁷,¹²]nonadecan-2-one
(1s,4r,6r,7s,12r,13s,16r,18r)-6,18-dihydroxy-8,8-dimethyl-17-methylidene-3,5-dioxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁷,¹²]nonadecan-2-one
(4bs,8as,9s,10r)-3,9,10-trihydroxy-2-isopropyl-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthrene-1,4-dione
(4bs,8as,9s,10r)-3,9,10-trihydroxy-2-isopropyl-4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthrene-1,4-dione
(3s,3ar,4s,4ar,7ar,8r,9ar)-3,4a,8-trimethyl-2,5-dioxo-3h,3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-4-yl 3-methylbutanoate
(3s,3ar,4s,4ar,7ar,8r,9ar)-3,4a,8-trimethyl-2,5-dioxo-3h,3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-4-yl 3-methylbutanoate
4-hydroxy-7,7a-dimethyl-4'-methylidene-2'-oxo-hexahydro-1h-spiro[indene-2,3'-oxolan]-3-yl 2-methylbut-2-enoate
4-hydroxy-7,7a-dimethyl-4'-methylidene-2'-oxo-hexahydro-1h-spiro[indene-2,3'-oxolan]-3-yl 2-methylbut-2-enoate
(1s,2s,6r,7r,12r)-12-isopropyl-2,6-dimethyl-9-oxo-13,14-dioxatetracyclo[10.2.2.0¹,¹⁰.0²,⁷]hexadec-10-ene-6-carboxylic acid
(1s,2s,6r,7r,12r)-12-isopropyl-2,6-dimethyl-9-oxo-13,14-dioxatetracyclo[10.2.2.0¹,¹⁰.0²,⁷]hexadec-10-ene-6-carboxylic acid
[(2r,3r)-3-{4-[(3-methylbutanoyl)oxy]phenyl}oxiran-2-yl]methyl (3s)-3-methylpentanoate
[(2r,3r)-3-{4-[(3-methylbutanoyl)oxy]phenyl}oxiran-2-yl]methyl (3s)-3-methylpentanoate
(1r,2r,4r,9r,12r,13r,16r)-2,12,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-11,15-dione
(1r,2r,4r,9r,12r,13r,16r)-2,12,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-11,15-dione
(1s,3e,7e,11s,12r,16r)-1-hydroxy-11-(hydroxymethyl)-3,7-dimethyl-15-methylidene-13,17-dioxatricyclo[9.5.1.1¹²,¹⁶]octadeca-3,7-dien-14-one
(1s,3e,7e,11s,12r,16r)-1-hydroxy-11-(hydroxymethyl)-3,7-dimethyl-15-methylidene-13,17-dioxatricyclo[9.5.1.1¹²,¹⁶]octadeca-3,7-dien-14-one
2-(3,7-dimethylocta-2,6-dien-1-yl)-5-(2-phenylethenyl)benzene-1,3-diol
2-(3,7-dimethylocta-2,6-dien-1-yl)-5-(2-phenylethenyl)benzene-1,3-diol
(1r,6r,8r,11s)-11-hydroperoxy-3,8,16-trimethyl-12-methylidene-7,18-dioxatricyclo[13.3.0.0⁶,⁸]octadeca-2,15-dien-17-one
(1r,6r,8r,11s)-11-hydroperoxy-3,8,16-trimethyl-12-methylidene-7,18-dioxatricyclo[13.3.0.0⁶,⁸]octadeca-2,15-dien-17-one
6-hydroxy-3,6,9-trimethyl-2-oxo-3h,3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylbut-2-enoate
6-hydroxy-3,6,9-trimethyl-2-oxo-3h,3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylbut-2-enoate
1-hydroperoxy-3,8,12,16-tetramethyl-7,18-dioxatricyclo[13.3.0.0⁶,⁸]octadeca-2,11,15-trien-17-one
1-hydroperoxy-3,8,12,16-tetramethyl-7,18-dioxatricyclo[13.3.0.0⁶,⁸]octadeca-2,11,15-trien-17-one
2,11,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-8,15-dione
2,11,16-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-8,15-dione
4,9,13-trimethyl-5-oxo-6,14-dioxatetracyclo[8.4.0.0¹,¹³.0³,⁷]tetradecan-11-yl 2-methylbut-2-enoate
4,9,13-trimethyl-5-oxo-6,14-dioxatetracyclo[8.4.0.0¹,¹³.0³,⁷]tetradecan-11-yl 2-methylbut-2-enoate
(1r,2s,4s,5s,6s,7r,8r)-5,6-dihydroxy-3,3,7,9-tetramethyl-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-4-yl (2z)-2-methylbut-2-enoate
(1r,2s,4s,5s,6s,7r,8r)-5,6-dihydroxy-3,3,7,9-tetramethyl-11-oxotricyclo[5.4.0.0²,⁸]undec-9-en-4-yl (2z)-2-methylbut-2-enoate
9,10,13-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
9,10,13-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
4-{2-[(4s,4as,8as)-4-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4h-naphthalen-1-yl]ethyl}-5-hydroxy-5h-furan-2-one
4-{2-[(4s,4as,8as)-4-hydroxy-2,5,5,8a-tetramethyl-3-oxo-4a,6,7,8-tetrahydro-4h-naphthalen-1-yl]ethyl}-5-hydroxy-5h-furan-2-one
(1s,4r,6s,9r,10r,12r,17s,18r)-4,10,18-trihydroxy-13,13-dimethyl-7-methylidene-3-oxapentacyclo[7.7.1.1⁶,⁹.0¹,¹².0⁴,¹⁷]octadecan-8-one
(1s,4r,6s,9r,10r,12r,17s,18r)-4,10,18-trihydroxy-13,13-dimethyl-7-methylidene-3-oxapentacyclo[7.7.1.1⁶,⁹.0¹,¹².0⁴,¹⁷]octadecan-8-one
(4s,4ar,5r,8ar,9ar)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
(4s,4ar,5r,8ar,9ar)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
(3s,4r,5r,6r,9r,12s)-3,4,12-trihydroxy-5-isopropyl-6,9-dimethyl-15-oxatetracyclo[7.6.1.0²,⁶.0¹³,¹⁶]hexadeca-1,13(16)-dien-14-one
(3s,4r,5r,6r,9r,12s)-3,4,12-trihydroxy-5-isopropyl-6,9-dimethyl-15-oxatetracyclo[7.6.1.0²,⁶.0¹³,¹⁶]hexadeca-1,13(16)-dien-14-one
4-{2-[(1s,2r,5r,7r,10s,11r,12s)-2-hydroxy-11,12-dimethyl-3,6-dioxatetracyclo[8.4.0.0¹,⁵.0⁵,⁷]tetradecan-11-yl]ethyl}-5h-furan-2-one
4-{2-[(1s,2r,5r,7r,10s,11r,12s)-2-hydroxy-11,12-dimethyl-3,6-dioxatetracyclo[8.4.0.0¹,⁵.0⁵,⁷]tetradecan-11-yl]ethyl}-5h-furan-2-one
5,14-dihydroxy-1,13-dimethyl-11-oxapentacyclo[8.6.1.1²,⁶.0²,⁸.0¹³,¹⁷]octadec-10(17)-ene-5-carboxylic acid
5,14-dihydroxy-1,13-dimethyl-11-oxapentacyclo[8.6.1.1²,⁶.0²,⁸.0¹³,¹⁷]octadec-10(17)-ene-5-carboxylic acid
(6s,6as,9s,10as)-4,6,9-trihydroxy-3-isopropyl-7,7,10a-trimethyl-6h,6ah,8h,9h,10h-benzo[c]isochromene-1-carbaldehyde
(6s,6as,9s,10as)-4,6,9-trihydroxy-3-isopropyl-7,7,10a-trimethyl-6h,6ah,8h,9h,10h-benzo[c]isochromene-1-carbaldehyde
(1s,2s,3s,4r,8s,9s,11r,12r)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1s,2s,3s,4r,8s,9s,11r,12r)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(2z)-3-[(2s,3as,5ar,9as,9bs)-3a,6,6,9a-tetramethyl-5-oxo-octahydronaphtho[2,1-b]furan-2-yl]-4-oxobut-2-enoic acid
(2z)-3-[(2s,3as,5ar,9as,9bs)-3a,6,6,9a-tetramethyl-5-oxo-octahydronaphtho[2,1-b]furan-2-yl]-4-oxobut-2-enoic acid
(4ar,5s,8s,8as,9as)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-8-yl 3-methylbut-2-enoate
(4ar,5s,8s,8as,9as)-8a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-8-yl 3-methylbut-2-enoate
7-butoxy-3-hydroxy-5-(1-hydroxyhexa-2,4-dien-1-ylidene)-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
7-butoxy-3-hydroxy-5-(1-hydroxyhexa-2,4-dien-1-ylidene)-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
(1s,2s,5r,8s,9r,10s,11r,15r)-9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
(1s,2s,5r,8s,9r,10s,11r,15r)-9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
9-[2-(furan-3-yl)ethyl]-4,5-dihydroxy-9,10,12-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-3-one
9-[2-(furan-3-yl)ethyl]-4,5-dihydroxy-9,10,12-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-3-one
(1s,2s,5s,6r,8r,11r,12r,15s)-5,15-dihydroxy-2,6,12-trimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
(1s,2s,5s,6r,8r,11r,12r,15s)-5,15-dihydroxy-2,6,12-trimethyl-16-oxapentacyclo[10.3.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecane-7,17-dione
(1s,3r,4s,7r,9r,10r,11s,13r)-4,9,13-trimethyl-5-oxo-6,14-dioxatetracyclo[8.4.0.0¹,¹³.0³,⁷]tetradecan-11-yl (2e)-2-methylbut-2-enoate
(1s,3r,4s,7r,9r,10r,11s,13r)-4,9,13-trimethyl-5-oxo-6,14-dioxatetracyclo[8.4.0.0¹,¹³.0³,⁷]tetradecan-11-yl (2e)-2-methylbut-2-enoate
(1r,2s,3s,4r,8r,9s,10r,12s)-10-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1r,2s,3s,4r,8r,9s,10r,12s)-10-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(6r)-6-[(1e,3s,6r)-6-(5,5-dimethyl-4-oxofuran-2-yl)-3-hydroxy-2-methylhept-1-en-1-yl]-4-methyl-5,6-dihydropyran-2-one
(6r)-6-[(1e,3s,6r)-6-(5,5-dimethyl-4-oxofuran-2-yl)-3-hydroxy-2-methylhept-1-en-1-yl]-4-methyl-5,6-dihydropyran-2-one
(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-{[(2s)-2-methylbutoxy]methyl}-2-(2-methylpropoxy)oxan-3-yl acetate
(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-{[(2s)-2-methylbutoxy]methyl}-2-(2-methylpropoxy)oxan-3-yl acetate
9-hydroxy-3,6,9-trimethyl-2-oxo-3h,3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylbutanoate
9-hydroxy-3,6,9-trimethyl-2-oxo-3h,3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylbutanoate
4,5-dihydroxy-6-[(2-methylbutoxy)methyl]-2-(2-methylpropoxy)oxan-3-yl acetate
4,5-dihydroxy-6-[(2-methylbutoxy)methyl]-2-(2-methylpropoxy)oxan-3-yl acetate
(3ar,4ar,6r,8s,8ar,9ar)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-octahydronaphtho[2,3-b]furan-6-yl 3-methylbutanoate
(3ar,4ar,6r,8s,8ar,9ar)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-octahydronaphtho[2,3-b]furan-6-yl 3-methylbutanoate
6-hydroxy-3,5a-dimethyl-9-methylidene-2-oxo-octahydronaphtho[1,2-b]furan-3-yl 2-methylbut-2-enoate
6-hydroxy-3,5a-dimethyl-9-methylidene-2-oxo-octahydronaphtho[1,2-b]furan-3-yl 2-methylbut-2-enoate
(1s,2s,3s,4r,8r,9s,11r,12r)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1s,2s,3s,4r,8r,9s,11r,12r)-11-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
9-hydroxy-3,6,9-trimethyl-2-oxo-3h,3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-4-yl 3-methylbutanoate
9-hydroxy-3,6,9-trimethyl-2-oxo-3h,3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-4-yl 3-methylbutanoate
8-hydroxy-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h,8h,8ah-naphtho[2,3-b]furan-4-yl 3-methylbutanoate
8-hydroxy-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h,8h,8ah-naphtho[2,3-b]furan-4-yl 3-methylbutanoate
3-{4-[(6-hydroperoxy-3,7-dimethylocta-2,7-dien-1-yl)oxy]-3-methoxyphenyl}prop-2-en-1-ol
3-{4-[(6-hydroperoxy-3,7-dimethylocta-2,7-dien-1-yl)oxy]-3-methoxyphenyl}prop-2-en-1-ol
({5-hexyl-7-oxo-decahydropyrrolo[2,1-j]quinolin-3-yl}methyl)sulfanylcarbonitrile
({5-hexyl-7-oxo-decahydropyrrolo[2,1-j]quinolin-3-yl}methyl)sulfanylcarbonitrile
4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-3-yl 2-methylbutanoate
4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-3-yl 2-methylbutanoate
2,6,11-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-3,15-dione
2,6,11-trihydroxy-5,5,9-trimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-3,15-dione
(2e)-3-(4-{[(2e,6r)-6-hydroperoxy-3,7-dimethylocta-2,7-dien-1-yl]oxy}-3-methoxyphenyl)prop-2-en-1-ol
(2e)-3-(4-{[(2e,6r)-6-hydroperoxy-3,7-dimethylocta-2,7-dien-1-yl]oxy}-3-methoxyphenyl)prop-2-en-1-ol
9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
9,10,15-trihydroxy-12,12-dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.1⁵,⁸.0¹,¹¹.0²,⁸]octadecan-7-one
6,10a,11-trihydroxy-4,4,8,11b-tetramethyl-1h,2h,3h,4ah,5h,6h,11h,11ah-phenanthro[3,2-b]furan-9-one
6,10a,11-trihydroxy-4,4,8,11b-tetramethyl-1h,2h,3h,4ah,5h,6h,11h,11ah-phenanthro[3,2-b]furan-9-one
(3r,3as,4r,4ar,9as,9br)-4a-hydroxy-3,5-dimethyl-9-methylidene-2-oxo-3h,3ah,4h,7h,8h,9ah,9bh-azuleno[1,2-b]furan-4-yl (2r)-2-methylbutanoate
(3r,3as,4r,4ar,9as,9br)-4a-hydroxy-3,5-dimethyl-9-methylidene-2-oxo-3h,3ah,4h,7h,8h,9ah,9bh-azuleno[1,2-b]furan-4-yl (2r)-2-methylbutanoate
(2z,4e)-2-[(3ar,4s,6ar,7r,9ar)-7-hydroxy-6a-methyl-1-oxo-octahydroindeno[4,3a-c]furan-4-yl]-6-hydroxy-6-methylhepta-2,4-dienal
(2z,4e)-2-[(3ar,4s,6ar,7r,9ar)-7-hydroxy-6a-methyl-1-oxo-octahydroindeno[4,3a-c]furan-4-yl]-6-hydroxy-6-methylhepta-2,4-dienal
(2e,4e)-2-[(3ar,4s,6ar,7r,9ar)-7-hydroxy-6a-methyl-3-oxo-octahydroindeno[4,3a-c]furan-4-yl]-6-hydroxy-6-methylhepta-2,4-dienal
(2e,4e)-2-[(3ar,4s,6ar,7r,9ar)-7-hydroxy-6a-methyl-3-oxo-octahydroindeno[4,3a-c]furan-4-yl]-6-hydroxy-6-methylhepta-2,4-dienal
(1r,2r,3s,4s,5s,8s,9s,12r)-5-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1r,2r,3s,4s,5s,8s,9s,12r)-5-hydroxy-4,8-dimethyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadecane-2,4-dicarboxylic acid
(1s,3e,7z,11s,12r,16r)-1-hydroxy-11-(hydroxymethyl)-3,7-dimethyl-15-methylidene-13,17-dioxatricyclo[9.5.1.1¹²,¹⁶]octadeca-3,7-dien-14-one
(1s,3e,7z,11s,12r,16r)-1-hydroxy-11-(hydroxymethyl)-3,7-dimethyl-15-methylidene-13,17-dioxatricyclo[9.5.1.1¹²,¹⁶]octadeca-3,7-dien-14-one
6-hydroxy-2-{7-hydroxy-6a-methyl-3-oxo-octahydroindeno[4,3a-c]furan-4-yl}-6-methylhepta-2,4-dienal
6-hydroxy-2-{7-hydroxy-6a-methyl-3-oxo-octahydroindeno[4,3a-c]furan-4-yl}-6-methylhepta-2,4-dienal
(4r,4ar,5s,8ar,9ar)-9a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
(4r,4ar,5s,8ar,9ar)-9a-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
(1s,3r,4s,7r,8r,10r,13r)-3,4,13-trimethyl-12-oxo-11,14-dioxatetracyclo[8.3.1.0¹,¹⁰.0³,⁸]tetradecan-7-yl 2-methylbut-2-enoate
(1s,3r,4s,7r,8r,10r,13r)-3,4,13-trimethyl-12-oxo-11,14-dioxatetracyclo[8.3.1.0¹,¹⁰.0³,⁸]tetradecan-7-yl 2-methylbut-2-enoate
3-{3-methoxy-4-[(3-methylbutanoyl)oxy]phenyl}prop-2-en-1-yl 3-methylbutanoate
3-{3-methoxy-4-[(3-methylbutanoyl)oxy]phenyl}prop-2-en-1-yl 3-methylbutanoate
2-(3,7-dimethylocta-2,6-dien-1-yl)-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
2-(3,7-dimethylocta-2,6-dien-1-yl)-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
(1r,5r,6s,8r,9r,11r)-9-[(1-hydroxyethenyl)oxy]-5,7,7,11-tetramethyl-4-oxotricyclo[6.3.0.0¹,⁵]undec-2-en-6-yl propanoate
(1r,5r,6s,8r,9r,11r)-9-[(1-hydroxyethenyl)oxy]-5,7,7,11-tetramethyl-4-oxotricyclo[6.3.0.0¹,⁵]undec-2-en-6-yl propanoate
(1r,2s,4r,5r,8r,9s,11r)-2-(hydroxymethyl)-13-isopropyl-5-methyltetracyclo[7.4.0.0²,¹¹.0⁴,⁸]tridec-12-ene-1,9-dicarboxylic acid
(1r,2s,4r,5r,8r,9s,11r)-2-(hydroxymethyl)-13-isopropyl-5-methyltetracyclo[7.4.0.0²,¹¹.0⁴,⁸]tridec-12-ene-1,9-dicarboxylic acid
(1s,2r,4as,8ar)-1-[2-(2-hydroxy-5-oxo-2h-furan-3-yl)ethyl]-1,2,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-4a-carboxylic acid
(1s,2r,4as,8ar)-1-[2-(2-hydroxy-5-oxo-2h-furan-3-yl)ethyl]-1,2,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-4a-carboxylic acid
(?)-12,16-dihydroxy-cis-cleroda-3,13-dien-15-oicacid-15,16-olide
NA
{"Ingredient_id": "HBIN000544","Ingredient_name": "(?)-12,16-dihydroxy-cis-cleroda-3,13-dien-15-oicacid-15,16-olide","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5792","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
14-deoxy-11-oxoandrographolide
14-deoxy-11-oxo-andrographolide
{"Ingredient_id": "HBIN001408","Ingredient_name": "14-deoxy-11-oxoandrographolide","Alias": "14-deoxy-11-oxo-andrographolide","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC12CCC(C(C1CCC(=C)C2C(=O)CC3=CC(=O)OC3)(C)CO)O","Ingredient_weight": "348.4 g/mol","OB_score": "57.05582639","CAS_id": "NA","SymMap_id": "SMIT00350","TCMID_id": "5199","TCMSP_id": "MOL008203","TCM_ID_id": "NA","PubChem_id": "101593061","DrugBank_id": "NA"}
15ξ-hydroxypinusolidicacid
NA
{"Ingredient_id": "HBIN001731","Ingredient_name": "15\u03be-hydroxypinusolidicacid","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC12CCCC(C1CCC(=C)C2CCC3=CC(OC3=O)O)(C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15904","TCMID_id": "10655","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-hydroxy-8(17),13-ent-labdadien-15,16-olid-19-oicacid
NA
{"Ingredient_id": "HBIN001908","Ingredient_name": "16-hydroxy-8(17),13-ent-labdadien-15,16-olid-19-oicacid","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC12CCCC(C1CCC(=C)C2CCC3=CC(=O)OC3O)(C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10297","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,6-dihydroxy-7(11)-eremophilen-12,8-olide; (3β,6β,8β,10β)-form,6-angeloyl
NA
{"Ingredient_id": "HBIN007719","Ingredient_name": "3,6-dihydroxy-7(11)-eremophilen-12,8-olide; (3\u03b2,6\u03b2,8\u03b2,10\u03b2)-form,6-angeloyl","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "NA","Ingredient_weight": "348.43","OB_score": "NA","CAS_id": "149475-45-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8238","PubChem_id": "NA","DrugBank_id": "NA"}
4-epihenryine
NA
{"Ingredient_id": "HBIN010363","Ingredient_name": "4-epihenryine","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC1(CCCC2(C1CC(C34C2C(=O)CC(C3O)C(=C)C4=O)O)C)CO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6928","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(?)-6β-hydroxy-5β,8β,9β,10α-cleroda-3,13-dien-16,15-olid-18-oicacid
NA
{"Ingredient_id": "HBIN012271","Ingredient_name": "(?)-6\u03b2-hydroxy-5\u03b2,8\u03b2,9\u03b2,10\u03b1-cleroda-3,13-dien-16,15-olid-18-oicacid","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC1CC(C2(C(C1(C)CCC3=CCOC3=O)CCC=C2C(=O)O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9921","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
adenostemmoic acid b
NA
{"Ingredient_id": "HBIN014704","Ingredient_name": "adenostemmoic acid b","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC1(CCCC2(C1CCC34C2(C(CC(C3)C(=C)C4=O)O)O)C)C(=O)O","Ingredient_weight": "348.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "24835","TCMSP_id": "NA","TCM_ID_id": "7153","PubChem_id": "21672519","DrugBank_id": "NA"}
amethystonal
NA
{"Ingredient_id": "HBIN015848","Ingredient_name": "amethystonal","Alias": "NA","Ingredient_formula": "C20H28O5","Ingredient_Smile": "CC1(CCCC2(C1CC(C34C2CC(C(C3O)C(=C)C4=O)O)O)C)C=O","Ingredient_weight": "348.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1038","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "14563770","DrugBank_id": "NA"}
(4e,4as,9r,11ar)-9-hydroperoxy-4-[(2e)-4-hydroxy-4-methylpent-2-en-1-ylidene]-7,11-dimethylidene-octahydrocyclonona[c]pyran-1-one
(4e,4as,9r,11ar)-9-hydroperoxy-4-[(2e)-4-hydroxy-4-methylpent-2-en-1-ylidene]-7,11-dimethylidene-octahydrocyclonona[c]pyran-1-one
(1r,4s,8s,9r,10r,12r)-9-hydroxy-4,8,10-trimethyl-9-[2-(5-oxo-2h-furan-3-yl)ethyl]-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-3-one
(1r,4s,8s,9r,10r,12r)-9-hydroxy-4,8,10-trimethyl-9-[2-(5-oxo-2h-furan-3-yl)ethyl]-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-3-one
(4as,5r,6r,6ar,7s,11as,11br)-5,6-dihydroxy-4,4,11b-trimethyl-1h,2h,3h,4ah,5h,6h,6ah,7h,11h,11ah-phenanthro[3,2-b]furan-7-carboxylic acid
(4as,5r,6r,6ar,7s,11as,11br)-5,6-dihydroxy-4,4,11b-trimethyl-1h,2h,3h,4ah,5h,6h,6ah,7h,11h,11ah-phenanthro[3,2-b]furan-7-carboxylic acid
(1r,6r,8r,12s)-12-hydroperoxy-3,8,12,16-tetramethyl-7,18-dioxatricyclo[13.3.0.0⁶,⁸]octadeca-2,10,15-trien-17-one
(1r,6r,8r,12s)-12-hydroperoxy-3,8,12,16-tetramethyl-7,18-dioxatricyclo[13.3.0.0⁶,⁸]octadeca-2,10,15-trien-17-one
2-{8,8a-dimethyl-7-[(2-methylbut-2-enoyl)oxy]-3-oxo-4,4a,5,6,7,8-hexahydronaphthalen-2-yl}propanoic acid
2-{8,8a-dimethyl-7-[(2-methylbut-2-enoyl)oxy]-3-oxo-4,4a,5,6,7,8-hexahydronaphthalen-2-yl}propanoic acid
(1s,4ar,5s,8ar)-5-[2-(5-hydroxy-2-oxo-5h-furan-3-yl)ethyl]-1,4a-dimethyl-6-methylidene-hexahydro-2h-naphthalene-1-carboxylic acid
(1s,4ar,5s,8ar)-5-[2-(5-hydroxy-2-oxo-5h-furan-3-yl)ethyl]-1,4a-dimethyl-6-methylidene-hexahydro-2h-naphthalene-1-carboxylic acid
1-[3-carboxy-3-(2-oxoethylidene)propyl]-1,4a,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-2-carboxylic acid
1-[3-carboxy-3-(2-oxoethylidene)propyl]-1,4a,5-trimethyl-2,3,4,7,8,8a-hexahydronaphthalene-2-carboxylic acid
8-hydroxy-3,6,10-trimethyl-2-oxo-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylbut-2-enoate
8-hydroxy-3,6,10-trimethyl-2-oxo-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylbut-2-enoate
methyl 4-{[5-(1-chloropropyl)-4-ethyl-2-methyloxolan-2-yl]methyl}-3-hydroxyhexanoate
methyl 4-{[5-(1-chloropropyl)-4-ethyl-2-methyloxolan-2-yl]methyl}-3-hydroxyhexanoate
(2s)-2-methyl-2-(4-methylpent-3-en-1-yl)-5-(2-phenylethyl)chromen-7-ol
(2s)-2-methyl-2-(4-methylpent-3-en-1-yl)-5-(2-phenylethyl)chromen-7-ol
{[(3r,5s,7ar,11ar)-5-hexyl-7-oxo-decahydropyrrolo[2,1-j]quinolin-3-yl]methyl}sulfanylcarbonitrile
{[(3r,5s,7ar,11ar)-5-hexyl-7-oxo-decahydropyrrolo[2,1-j]quinolin-3-yl]methyl}sulfanylcarbonitrile
4,6-bis(3-methylbut-2-en-1-yl)-5-(2-phenylethenyl)benzene-1,3-diol
4,6-bis(3-methylbut-2-en-1-yl)-5-(2-phenylethenyl)benzene-1,3-diol
2-[(1s,2s,5s)-5-methyl-2-(prop-1-en-2-yl)cyclohexyl]-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
2-[(1s,2s,5s)-5-methyl-2-(prop-1-en-2-yl)cyclohexyl]-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
methyl (3r,4r)-4-{[(2r,4r,5r)-5-[(1r)-1-chloropropyl]-4-ethyl-2-methyloxolan-2-yl]methyl}-3-hydroxyhexanoate
methyl (3r,4r)-4-{[(2r,4r,5r)-5-[(1r)-1-chloropropyl]-4-ethyl-2-methyloxolan-2-yl]methyl}-3-hydroxyhexanoate
(6as,9s,10as)-6,6,9-trimethyl-3-[(1e)-2-phenylethenyl]-6ah,7h,8h,9h,10h,10ah-benzo[c]isochromen-1-ol
(6as,9s,10as)-6,6,9-trimethyl-3-[(1e)-2-phenylethenyl]-6ah,7h,8h,9h,10h,10ah-benzo[c]isochromen-1-ol
2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
4,6-bis(3-methylbut-2-en-1-yl)-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
4,6-bis(3-methylbut-2-en-1-yl)-5-[(1e)-2-phenylethenyl]benzene-1,3-diol
