Exact Mass: 330.144
Exact Mass Matches: 330.144
Found 500 metabolites which its exact mass value is equals to given mass value 330.144
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
GA7-1
Gibberellin A7 (GA7) is a plant hormone. Gibberellin A7 is the metabolite of Gibberella fujikuroi. Gibberellin A7 promotes the plant growth and elongation of cells[1].
Gibberellin A5
Gibberellin A5 is a C19-gibberellin initially identified in Gibberella fujikuroi and differing from gibberellin A1 by the absence of the OH at C-2 and the presence of a double bond between C-3 and C-3 (gibbane numbering). It has a role as a plant metabolite and a mouse metabolite. It is a lactone, a C19-gibberellin and a gibberellin monocarboxylic acid. Gibberellin A5 is a natural product found in Prunus persica var. nucipersica, Cucumis melo, and other organisms with data available. A C19-gibberellin initially identified in Gibberella fujikuroi and differing from gibberellin A1 by the absence of the OH at C-2 and the presence of a double bond between C-3 and C-3 (gibbane numbering).
gibberellin A51-catabolite
A tetracyclic diterpenoid obtained by catabolism of gibberellin A51.
17alpha-Chloroethynylestradiol
Oxomemazine
R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use > R06AD - Phenothiazine derivatives C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent Oxomemazine is a first-generation phenothiazine H1-antihistamine. Oxomemazine is a phenothiazine-based histamine H1-receptor blocker with pronounced antimuscarinic properties. Oxomemazine is a selective antagonist for muscarinic M1 receptor, displays about 20-fold difference in the affinity for high (Ki = 84 nM, M1 receptor) and low (Ki = 1.65 μM, M2 receptor) affinity sites[1]. Oxomemazine?an antihistamine and anticholinergic agent used for the study of cough treatment[2].
2-(2-hydroxypropan-2-yl)-6-[2-(oxiran-2-yl)propan-2-yl]-2H,3H,7H-furo[3,2-g]chromen-7-one
Hericenone A
Hericenone A is found in mushrooms. Hericenone A is a constituent of the edible lions mane mushroom (Hericium erinaceum) Constituent of the edible lions mane mushroom (Hericium erinaceum). Hericenone A is found in mushrooms.
Gibberellin A95
Gibberellin A95 (GA95) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A95 is found in fruits. Gibberellin A95 is a constituent of Prunus cerasus (cherry) seeds. Constituent of Prunus cerasus (cherry) seeds. Gibberellin A95 is found in fruits, sour cherry, and peach.
Gibberellin A62
Gibberellin A62 (GA62) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A62 is found in apple. Gibberellin A62 is a constituent of Pyrus malus (apple). Constituent of Pyrus malus (apple). Gibberellin A62 is found in apple, pomes, and common wheat.
Fragransol B
Fragransol B is found in herbs and spices. Fragransol B is a constituent of Myristica fragrans (nutmeg). Constituent of Myristica fragrans (nutmeg). Fragransol B is found in nutmeg and herbs and spices.
Gibberellin A88
Gibberellin A88 (GA88) belongs to the class of organic compounds known as terpene lactones. These are prenol lipids containing a lactone ring. Gibberellin A88 is found in apple. Gibberellin A88 is a constituent of apple seeds (Malus domestica). Constituent of apple seeds (Malus domestica). Gibberellin A88 is found in apple and pomes.
Gibberellin A121
Gibberellin A121 (GA121) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A121 is found in fruits. Gibberellin A121 is a constituent of immature Prunus persica (peach) seeds. Constituent of immature Prunus persica (peach) seeds. Gibberellin A121 is found in fruits and peach.
Gibberellin A108
Gibberellin A108 is found in apple. Gibberellin A108 is a constituent of apple seeds (Malus domestica) Constituent of apple seeds (Malus domestica). Gibberellin A108 is found in apple and pomes.
Gibberellin A105
Gibberellin A105 is found in apple. Gibberellin A105 is a constituent of apple seeds (Malus domestica) Constituent of apple seeds (Malus domestica). Gibberellin A105 is found in apple and pomes.
Clomipramine N-oxide
Clomipramine N-oxide is a metabolite of clomipramine. Clomipramine (trademarked as Anafranil) is a tricyclic antidepressant (TCA). It was developed in the 1960s by the Swiss drug manufacturer Geigy (now known as Novartis) and has been in clinical use worldwide ever since. (Wikipedia)
Hydroxyclomipramine
A class of glycerophospholipid in which a phosphorylethanolamine moiety occupies a glycerol substitution site. As is the case with diacylglycerols, glycerophosphocholines can have many different combinations of fatty acids of varying lengths and saturation attached at the SN-1 and SN-2 positions. fatty acids containing 16, 18 and 20 carbons are the most common. (LipidMAPS) Hydroxyclomipramine is a metabolite of clomipramine. Clomipramine (trademarked as Anafranil) is a tricyclic antidepressant (TCA). It was developed in the 1960s by the Swiss drug manufacturer Geigy (now known as Novartis) and has been in clinical use worldwide ever since. (Wikipedia)
2-Hydroxyclomipramine
2-Hydroxyclomipramine is a metabolite of clomipramine. Clomipramine (trademarked as Anafranil) is a tricyclic antidepressant (TCA). It was developed in the 1960s by the Swiss drug manufacturer Geigy (now known as Novartis) and has been in clinical use worldwide ever since. (Wikipedia)
8-Hydroxyclomipramine
8-Hydroxyclomipramine is a metabolite of clomipramine. Clomipramine (trademarked as Anafranil) is a tricyclic antidepressant (TCA). It was developed in the 1960s by the Swiss drug manufacturer Geigy (now known as Novartis) and has been in clinical use worldwide ever since. (Wikipedia)
N,N-Dimethyl-1-[5-[2-[[(E)-1-(methylamino)-2-nitroethenyl]amino]ethylsulfanylmethyl]furan-2-yl]methanamine oxide
(4Bs,8aR,10aS)-10a-ethynyl-4b,8,8-trimethyl-3,7-dioxo-3,4b,7,8,8a,9,10,10a-octahydrophenanthrene-2,6-dicarbonitrile
Ranitidine N-oxide
Ranitidine S-oxide
Gibberellin A7
Gibberellin a7 is a member of the class of compounds known as c19-gibberellin 6-carboxylic acids. C19-gibberellin 6-carboxylic acids are c19-gibberellins with a carboxyl group at the 6-position. Gibberellin a7 is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a7 can be found in a number of food items such as common wheat, corn, apple, and chayote, which makes gibberellin a7 a potential biomarker for the consumption of these food products. Gibberellin A7 (GA7) is a plant hormone. Gibberellin A7 is the metabolite of Gibberella fujikuroi. Gibberellin A7 promotes the plant growth and elongation of cells[1].
Gibberellin A5
Gibberellin a5 is a member of the class of compounds known as c19-gibberellin 6-carboxylic acids. C19-gibberellin 6-carboxylic acids are c19-gibberellins with a carboxyl group at the 6-position. Gibberellin a5 is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a5 can be found in a number of food items such as tea, apricot, common pea, and sweet cherry, which makes gibberellin a5 a potential biomarker for the consumption of these food products.
gibberellin A51-catabolite
Gibberellin a51-catabolite is a member of the class of compounds known as c19-gibberellin 6-carboxylic acids. C19-gibberellin 6-carboxylic acids are c19-gibberellins with a carboxyl group at the 6-position. Gibberellin a51-catabolite is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a51-catabolite can be found in a number of food items such as grapefruit/pummelo hybrid, garden rhubarb, black huckleberry, and italian sweet red pepper, which makes gibberellin a51-catabolite a potential biomarker for the consumption of these food products.
(+)-7-(6,7-Epoxy-3,7-dimethyl-5-oxooctanoxy)-coumarin
[4S-(4alpha,4aalpha,5alpha,6alpha)]-4,4a,5,6,7,9-Hexahydro-6-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-propenoic acid
[3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-2,3,3a,4,5,7,7a,8a,8b,8c-Decahydro-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-7-yl ester 2-methyl-2-propenoic acid
(E)-7-(6-Hydroperoxy-3,7-dimethylocta-2,7-dienyloxy)coumarin
2-(2,3-Dihydroxy-3-methylbutyl)-5-[2-(4-hydroxyphenyl)ethenyl]-1,3-benzenediol
2,3,4,7-Tetrahydro-5-methoxy-2-methyl-2-(4-methyl-2-oxo-3-pentenyl)-9H-furo[3,4-h]-1-benzopyran-9-one
Ranitidine N-oxide
A N-oxide derivative of ranitidine. CONFIDENCE standard compound; EAWAG_UCHEM_ID 2738 CONFIDENCE standard compound; INTERNAL_ID 2194
Ranitidine S-oxide
CONFIDENCE standard compound; EAWAG_UCHEM_ID 2737 EAWAG_UCHEM_ID 2737; CONFIDENCE standard compound CONFIDENCE standard compound; INTERNAL_ID 2193
1,4-diangelyoxy-2-(E-3-methyloxiranyl)benzene|4-(2-methyl-2-Z-butenoyloxy)-2-(3-methyloxiran-2-yl)-phenyl 2-methyl-2-Z-butanoate|Diangeloyl-2-(3-Methyl-2-oxiranyl)-1,4-benzenediol
(E)-6-(7-hydroperoxy-3,7-dimethylocta-2,5-dienyl)-7-hydroxycoumarin|7-Hydroperoxide-7-Hydroxy-6-(7-hydroxy-3,7-dimethyl-2,5-octadienyl)-2H-1-benzopyran-2-one
3-Hydroxy-4-(3,7-dimethyl-5-oxo-2,6-octadienyl)-5-methoxy-benzo[1,2-c]furan-2-one|hericenone A|hericenone-A
8alpha-(2-methylacryloyloxy)-1beta,5betaH-4alpha,7alpha-epoxybourbon-11(13)-en-6-12-olide
6beta-methacryloyloxy-1,10beta-epoxyfuroeremophil-9-one
6-hydroxy-7-(5-hydroxy-3,7-dimethylocta-2,6-dien)-oxycoumarin|6-hydroxy-7-[(E)-3,7-dimethyl-5-hydroxy-2,6-octadienyloxy]coumarin|6-hydroxy-7-[(E,E)-3?,7?-dimethyl-5?-hydroxy-2?,6?-octadienyloxy]coumarin
(3S,5R,6S,7R)-5,6-Dihydroxy-1,7-bis(4-hydroxyphenyl)-de-O-methylcentrolobine|(3S,5RS,6SR,7R)-5,6-Dihydroxy-1,7-bis(4-hydroxyphenyl)-de-O-methylcentrolobine
7-[[5-(3,3-Dimethyloxiranyl)-5-oxo-3-methylpentyl]oxy]-2H-1-benzopyran-2-one
1-(2-hydroxy-3,4,5,6-tetramethoxyphenyl)-3-phenylpropene
(7R,8R,1R,2R,3S,4S)-Delta8-2,4-dihydroxy-3,4-methylenedioxy-1,2,3,4,5,6-hexahydro-5-oxo-7,3,8,1-neolignan
6-O-(2-methylpropenoyl)-3-hydroxy-4(15),10(14),11(13)-guaiatrien-12,8-olide
2-Methylpropenoic acid [(4S)-4,4a,5,6,7,9-hexahydro-6beta-hydroxy-3,4abeta,5beta-trimethyl-9-oxonaphtho[2,3-b]furan-4beta-yl] ester
7-(5,6-Dihydroxy-3,7-dimethylocta-2,7-dienyloxy)-coumarin
2,8,9,11,17-pentahydroxy[7.0]metacyclophane|ostryopsitriol
8(S)-O-(2-methylbutanoyl)-8,9-dihydrooroselol|8(S)-[2-(2(S)-methylbutanoyl)oxypropan-2-yl]-8,9-dihydro-2H-furo[2,3-h]chromen-2-one
(10S)-11,12-dihydroxy-6-methoxy-15,16-dinorpimara-5,8,11,13-tetraene-3,7-dione|11,12-dihydroxy-6-methoxy-15,16-dinor-ent-pimara-5,8,11,13-tetraene-3,7-dione|dryperrein A
6-hydroxy-7-(7-hydroxy-3,7-dimethylocta-2,5-dien)-oxycoumarin|6-hydroxy-7-[(E,E)-3,7-dimethyl-7-hydroxy-2,5-octadienyloxy]coumarin
(?)-threo-3,4-epoxy-1-(4-hydroxyphenyl)-7-(3-methoxyphenyl)heptan-2,3-diol|engelhardiol B
3-(2,3-dihydroxy-3-methylbutyl)resveratrol|Anticancer Stilbenoid PMV70P691-038
3-methoxy-4,9,9-trihydroxy-4,7-epoxy-5,8-neolignan|chushisizin E
8,8-Dimethyl-2-oxopyrano[6,5-f]chroman-9-yl 3-methylbutanoate
5-methoxy-2-methyl-2-(4-methyl-2-oxopent-3-enyl)-3,4-dihydro-2H-furo[3,4-h]chromen-7(9H)-one|hericenone I
2-(3-Methoxy-4-hydroxyphenyl)-5-(3-hydroxypropyl)-2,3-dihydrobenzofuran-3-methanol
6-(3-Methyl-2-butenyloxy)-8-(1-hydroxy-1-methylethyl)-8,9-dihydro-2H-furo[2,3-h]-1-benzopyran-2-one
2,4-dihydroxy-3,5-dimethyl-4,6-dimethoxydihydrochalcone|2,4-dihydroxy-4,6-dimethoxy-3,5-dimethyldihydrochalcone
3-(methacryloyloxy)furanoeremophilan-15,6alpha-olide
(7S,8S,7S,8S)-3,3,4-Trihydroxy-4-methoxy-7,7-epoxylignan
16(R)-methyl-1,15-dioxo-6,7-seco-6-nor-15(8->9)-abeo-5,8-epoxy-ent-kaur-2-en-7,20-olide|maoecrystal V
Lathanol
Sodium lauryl sulfoacetate is a wetting agent and surfactant used in enema-type laxative products.
Cinchonine HCl
3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate
7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one
C19H22O5_(1R,2S,3S,4S,7R,10R,13R,17R)-17-Hydroxy-4-methyl-14-methylene-5-oxo-6-oxapentacyclo[11.2.1.1~4,7~.0~1,10~.0~3,9~]heptadec-8-ene-2-carboxylic acid
gibberellin A7
A C19-gibberellin that is a pentacyclic diterpenoid responsible for promoting growth and development in plants. Initially identified in Gibberella fujikuroi, it differs from gibberellin A1 in lacking the OH at C-7 (gibbane numbering). Gibberellin A7 (GA7) is a plant hormone. Gibberellin A7 is the metabolite of Gibberella fujikuroi. Gibberellin A7 promotes the plant growth and elongation of cells[1].
C19H22O5_(3aR,4aR,7aR,8R,9aR)-4a,8-Dimethyl-3-methylene-2,5-dioxo-2,3,3a,4,4a,5,7a,8,9,9a-decahydroazuleno[6,5-b]furan-4-yl methacrylate
C19H22O5_Spiro[furan-3(2H),1(7H)-naphthalene]-2,7-dione, 5-(3-furanyl)-2,3,4,4,4a,5,8,8a-octahydro-4a-hydroxy-2,5-dimethyl
5-(furan-3-yl)-4a-hydroxy-4,7-dimethylspiro[5,6,7,8a-tetrahydro-1H-naphthalene-8,3-oxolane]-2,2-dione
3-Heptanone, 7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)-
1,7-bis(3,4-dihydroxyphenyl)heptan-3-one
D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents D018926 - Anti-Allergic Agents
3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate
Oxomemazine
R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use > R06AD - Phenothiazine derivatives C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent Oxomemazine is a phenothiazine-based histamine H1-receptor blocker with pronounced antimuscarinic properties. Oxomemazine is a selective antagonist for muscarinic M1 receptor, displays about 20-fold difference in the affinity for high (Ki = 84 nM, M1 receptor) and low (Ki = 1.65 μM, M2 receptor) affinity sites[1]. Oxomemazine?an antihistamine and anticholinergic agent used for the study of cough treatment[2].
7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one [IIN-based: Match]
7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one [IIN-based on: CCMSLIB00000847711]
3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based: Match]
3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate [IIN-based on: CCMSLIB00000845015]
3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate_major
3-(4-hydroxy-3-methoxyphenyl)propyl 3-(4-hydroxyphenyl)propanoate_minor
Ala Gly Pro Ser
Ala Gly Ser Pro
Ala Pro Gly Ser
Fragransol B
Gibberellin A62
Hericenone A
Gibberellin A88
Gibberellin A95
5-(furan-3-yl)-4a-hydroxy-2,5-dimethyl-2,3,4,4,4a,5,8,8a-octahydro-2H,7H-spiro[furan-3,1-naphthalene]-2,7-dione
Ethyl 4-acetoxy-8-isopropyl-6-methoxy-2-naphthoate
Ethyl 4-acetoxy-6-isopropyl-8-methoxy-2-naphthoate
(5R)-2-Isopropyl-5-methylcyclohexyl (2S,5R)-5-acetoxy-1,3-oxathio lane-2-carboxylate
(3-Fluoro-4-morpholin-4-ylphenyl)carbamic acid benzyl ester
3-ethyl-2-[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)vinyl]benzoxazolium chloride
2,5,7,10-Tetraoxa-6-silaundecane,6-(2-methoxyethoxy)-6-phenyl-
BIS((3AR,8AS)-8,8A-DIHYDRO-3AH-INDENO[1,2-D]OXAZOL-2-YL)METHANE
methyl 4-[1-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]benzoate
1-Piperazinecarboxaldehyde, 4-[(2,3,4-trimethoxyphenyl)methyl]-, hydrochloride
1H-Cyclopenta[b]quinoline-9-carboxamide,N-(3-acetylphenyl)-2,3-dihydro-(9CI)
METHYL 4-(3-(4-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL)BICYCLO[2.2.2]OCTANE-1-CARBOXYLATE
(R)-2-(5-CYANO-6-FLUORO-8-METHYL-1-PROPYL-1,3,4,9-TETRAHYDROPYRANO[3,4-B]INDOL-1-YL)ACETIC ACID
BIS((3AS,8AR)-8,8A-DIHYDRO-3AH-INDENO[1,2-D]OXAZOL-2-YL)METHANE
(S)-3-(tert-butyl)-4-(2,6-dimethoxyphenyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole
1-[[2-[(2-AMinophenyl)aMino]-5-Methyl-3-thienyl]carbonyl]-4-Methyl-piperazine
(R)-3-(tert-butyl)-4-(2,6-dimethoxyphenyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole
2-[(3S)-1-Azabicyclo[2.2.2]oct-3-yl] 2,4,5,6-tetrahydro-1H-benzo[de]isoquinolin-1-one hydrochloride
METHYL 1-CYCLOHEXYL-5-(4-METHYLSULFANYL-PHENYL)-1H-PYRAZOLE-3-CARBOXYLATE
Ethynerone
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone
2-Deoxy-5-(4,5-dihydroxypentyl)uridine
A pyrimidine 2-deoxyribonucleoside having 5-(4,5-dihydroxypentyl)uracil as the nucleobase.
2-[(3-Methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-1-yl)oxy]acetic acid propan-2-yl ester
7-(3,4-Dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one
N-(1-propyl-1H-1,3-benzodiazol-2-yl)quinoline-2-carboxamide
3-Amino-3-benzyl-[4.3.0]bicyclo-1,6-diazanonan-2-one
3-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-3,4-dihydro-2H-chromen-4-ol
14-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-12-ene-9-carboxylic acid
12-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-2-ene-9-carboxylic acid
(1R,2R,5S,8S,9S,10R,11S)-5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-12-ene-9-carboxylic acid
1-(3,4-Dimethoxy-2-methylphenyl)-2-(3,4-dimethoxyphenyl)ethanone
1-Ethyl-3-[[[2-(2-methylpropyl)-4-quinolinyl]-oxomethyl]amino]thiourea
6-(hexylthio)-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile
N-cyclopentyl-2-[(6-methoxy-3-methyl-2-quinolinyl)thio]acetamide
1-[5-[3-(Dimethylamino)phenyl]-2-thiazolyl]-4-piperidinecarboxamide
N-cyclopropyl-2-[[2-(4-ethylphenyl)-5-methyl-4-oxazolyl]methylthio]acetamide
1-[4-[4-(Dimethylamino)phenyl]-2-thiazolyl]-4-piperidinecarboxamide
N2-(3-methylphenyl)-6-(4-morpholinyl)-5-nitropyrimidine-2,4-diamine
4,5-dihydrobenzo[g][1,2]benzoxazol-3-yl(3,4-dihydro-2H-quinolin-1-yl)methanone
1-[[3-(4-Chlorophenoxy)phenyl]methyl]-4-ethylpiperazine
N-(4-isobutoxybenzylidene)-4,5-dimethyl-3-thiophenecarbohydrazide
N-[2-(1-cyclohexenyl)ethyl]-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
2-[(7-methyl-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-9-yl)oxy]acetic acid butyl ester
4-methyl-N-[(4-methylphenyl)methyl]-2-furo[3,2-c]quinolinecarboxamide
1-[4-[(E)-2-(4-methoxyphenyl)ethenyl]pyridin-1-ium-1-yl]-2-phenylethanone
6-(1-Hydroxy-2-methylbut-3-en-2-yl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrouro[3,2-g]chromen-7-one
10-[(2S)-3-(dimethylamino)-2-methylpropyl]phenothiazine-2,7-diol
10-[(2S)-3-(dimethylamino)-2-methylpropyl]phenothiazine-2,3-diol
3-Hydroxy-2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)-2,3-dihydrouro[3,2-g]chromen-7-one
(1R,3R,6S,7E,10S,12R)-17-hydroxy-3,10,12-trimethyl-16-oxatricyclo[12.2.1.01,6]heptadeca-4,7,14(17)-triene-9,13,15-trione
(2R,4S,6E,8E,10E)-1-(4-hydroxy-5-methylidene-2-oxofuran-3-yl)-2,4-dimethyldodeca-6,8,10-triene-1,5-dione
2,5-dihydroxy-6-[(1z)-2-(6-methyl-3,6-dihydro-1,2-dioxin-3-yl)ethenyl]-3-(3-methylbut-2-en-1-yl)benzaldehyde
7-[(5,6-dihydroxy-3,7-dimethylocta-2,7-dien-1-yl)oxy]chromen-2-one
[2-methoxy-3-(3-methylbut-2-en-1-yl)-4-oxochromen-5-yl]methyl propanoate
7-[(7-hydroxy-3,7-dimethyl-6-oxooct-2-en-1-yl)oxy]chromen-2-one
(1e,3e)-3,7-dimethyl-5-oxoocta-1,3,6-trien-1-yl 3,4-dimethoxybenzoate
7a-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-methyl-3a-(prop-2-en-1-yl)-3,4-dihydro-2h-1-benzofuran-7-one
(1r,2r,4s,8r,10r,13r,16r)-11-methyl-4-(prop-1-en-2-yl)-14,17-dioxapentacyclo[8.5.1.1⁸,¹¹.0²,⁸.0¹³,¹⁶]heptadecane-6,9,15-trione
1-[2-methoxy-3-(3-methylbut-2-en-1-yl)-4-oxochromen-5-yl]ethyl acetate
(11r)-2-methoxy-11-methyl-11-(4-methyl-2-oxopent-3-en-1-yl)-5,10-dioxatricyclo[7.4.0.0³,⁷]trideca-1,3(7),8-trien-6-one
4-hydroxy-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-8-yl 2-methylprop-2-enoate
(1s,4r,10s,11r,13s,16s)-11-hydroxy-11-methyl-4-(prop-1-en-2-yl)-14-oxatetracyclo[8.5.1.0²,⁸.0¹³,¹⁶]hexadec-2(8)-ene-6,9,15-trione
(1s,4s,5r,6s,7s,8r)-6-(2h-1,3-benzodioxol-5-yl)-4,8-dihydroxy-7-methyl-1-(prop-2-en-1-yl)bicyclo[3.2.1]octan-3-one
(1s,2r,5s,8r,9s,10r,11s)-5-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid
(5s)-7-(3,4-dihydroxyphenyl)-5-hydroxy-1-(4-hydroxyphenyl)heptan-3-one
(6r)-6-{[(2s,4s,5s,6r)-4,5-dihydroxy-6-[(1e)-2-phenylethenyl]oxan-2-yl]methyl}-5,6-dihydropyran-2-one
(2r,3s,3ar,7as)-7a-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-methyl-3a-(prop-2-en-1-yl)-3,4-dihydro-2h-1-benzofuran-7-one
1-[6-methoxy-3-oxo-2-(propan-2-ylidene)-1-benzofuran-5-yl]ethyl 3-methylbut-2-enoate
(1s,2s,6s,11r,12r,14s)-9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.0²,⁶.0¹²,¹⁴]tetradec-9-en-11-yl 2-methylprop-2-enoate
2,5-dihydroxy-8,8-dimethyl-10-(3-methylbut-2-en-1-yl)-2h,3h-pyrano[3,2-g]chromen-4-one
5-[(1s,2r)-2,3-dihydroxy-1-methoxypropyl]-3'-(prop-2-en-1-yl)-[1,1'-biphenyl]-2,4'-diol
(2s)-2-(2-hydroxypropan-2-yl)-6-{2-[(2s)-oxiran-2-yl]propan-2-yl}-2h,3h-furo[3,2-g]chromen-7-one
8-hydroxy-6-isopropyl-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-2,6,13-triene-4,11-dione
4-[(2s,3s,4s,5s)-5-(3-hydroxy-4-methoxyphenyl)-3,4-dimethyloxolan-2-yl]benzene-1,2-diol
13-hydroxy-4-methyl-14-methylidene-5-oxo-6-oxapentacyclo[11.2.1.1⁴,⁷.0¹,¹⁰.0³,⁹]heptadec-8-ene-2-carboxylic acid
(2s)-2,5-dihydroxy-8,8-dimethyl-10-(3-methylbut-2-en-1-yl)-2h,3h-pyrano[3,2-g]chromen-4-one
(4s,4ar,5r,6s)-6-hydroxy-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h-naphtho[2,3-b]furan-4-yl 2-methylprop-2-enoate
(2s)-2-(2,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2h-1-benzopyran
9,14-dimethyl-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.0²,⁶.0¹²,¹⁴]tetradec-9-en-11-yl 2-methylprop-2-enoate
5-({8,8-dimethyl-2-oxo-3ah,4h,5h,6h,7h,8bh-indeno[1,2-b]furan-3-ylidene}methoxy)-3-methyl-5h-furan-2-one
(1z,3r,4r,6r,8r,11r,13r,15r)-13-hydroxy-6-methyl-16-oxatetracyclo[13.2.2.0³,¹¹.0⁴,⁸]nonadeca-1,9-diene-7,17,18-trione
[(3r,3ar,7as)-3-hydroxy-3-methyl-3a,4,5,7a-tetrahydro-2h-1-benzofuran-6-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate
(1s,2s,5r,7r,8s,9s,10r,11r,14r)-14-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxahexacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁷.0²,⁸]heptadecane-9-carboxylic acid
12-epi-methyl-barbascoate
{"Ingredient_id": "HBIN000844","Ingredient_name": "12-epi-methyl-barbascoate","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6966","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-hydroxy-4-(3,7-dimethyl-5-oxo-2,6-octa-dienyl)-5-methoxy-benzo[1,2-c]furan-2-one
{"Ingredient_id": "HBIN008652","Ingredient_name": "3-hydroxy-4-(3,7-dimethyl-5-oxo-2,6-octa-dienyl)-5-methoxy-benzo[1,2-c]furan-2-one","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "CC(=CC(=O)CC(=CCC1=C(C=C2COC(=O)C2=C1O)OC)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10054","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s,5r,6s,7r)-5,6-dihydroxy-1,7-bis(4-hydroxy-phenyl)-de-o-methylcentrolobine
{"Ingredient_id": "HBIN009658","Ingredient_name": "(3s,5r,6s,7r)-5,6-dihydroxy-1,7-bis(4-hydroxy-phenyl)-de-o-methylcentrolobine","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "C1C(OC(C(C1O)O)C2=CC=C(C=C2)O)CCC3=CC=C(C=C3)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5776","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s,5s,6r,7r)-5,6-dihydroxy-1,7-bis(4-hydroxy-phenyl)-de-o-methylcentrolobine
{"Ingredient_id": "HBIN009670","Ingredient_name": "(3s,5s,6r,7r)-5,6-dihydroxy-1,7-bis(4-hydroxy-phenyl)-de-o-methylcentrolobine","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "C1C(OC(C(C1O)O)C2=CC=C(C=C2)O)CCC3=CC=C(C=C3)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5777","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s,5s,6s,7r)-5,6-dihydroxy-1,7-bis(4-hydroxy-phenyl)-4 ′′-de-o-methylcentrolobine
{"Ingredient_id": "HBIN009672","Ingredient_name": "(3s,5s,6s,7r)-5,6-dihydroxy-1,7-bis(4-hydroxy-phenyl)-4 \u2032\u2032-de-o-methylcentrolobine","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "C1C(OC(C(C1O)O)C2=CC=C(C=C2)O)CCC3=CC=C(C=C3)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5778","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5β-hydroxy-cis-dehydrocrotonin
{"Ingredient_id": "HBIN011473","Ingredient_name": "5\u03b2-hydroxy-cis-dehydrocrotonin","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "CC1CCC2(C(C13CC(OC3=O)C4=COC=C4)CC(=O)C=C2C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9971","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(5s,6s)-5,6-dihydroxy-4''-de-o-methylcentro-lobine
{"Ingredient_id": "HBIN011944","Ingredient_name": "(5s,6s)-5,6-dihydroxy-4''-de-o-methylcentro-lobine","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5803","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(7s,8s,7's,8's)-3,3',4'-trihydroxy-4-methoxy-7,7'-epoxylignan
{"Ingredient_id": "HBIN013478","Ingredient_name": "(7s,8s,7's,8's)-3,3',4'-trihydroxy-4-methoxy-7,7'-epoxylignan","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "CC1C(C(OC1C2=CC(=C(C=C2)O)O)C3=CC(=C(C=C3)OC)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21755","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
aguerin B
{"Ingredient_id": "HBIN014919","Ingredient_name": "aguerin B","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "CC(=C)C(=O)OC1CC(=C)C2CC(C(=C)C2C3C1C(=C)C(=O)O3)O","Ingredient_weight": "330.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32709","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "155102","DrugBank_id": "NA"}
anticancerstilbenoid pmv70p691-038
{"Ingredient_id": "HBIN016358","Ingredient_name": "anticancerstilbenoid pmv70p691-038","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1442","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
auraptene; Δ7'-isomer,5',6'-dihydroxy
{"Ingredient_id": "HBIN017366","Ingredient_name": "auraptene; \u03947'-isomer,5',6'-dihydroxy","Alias": "NA","Ingredient_formula": "C19H22O5","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6474","PubChem_id": "NA","DrugBank_id": "NA"}