Exact Mass: 332.1633
Exact Mass Matches: 332.1633
Found 325 metabolites which its exact mass value is equals to given mass value 332.1633
,
within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error
0.0002 dalton.
Gibberellin A4
A C19-gibberellin, initially identified in Gibberella fujikuroi and differing from gibberellin A1 by the substitution of the OH at C-7 (gibbane numbering) by H. D006133 - Growth Substances > D010937 - Plant Growth Regulators > D005875 - Gibberellins Acquisition and generation of the data is financially supported in part by CREST/JST. CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 16
gibberellin A20
A C19-gibberellin that is a pentacyclic diterpenoid responsible for promoting growth and development. Initially identified in Gibberella fujikuroi, it differs from gibberellin A1 in lacking an OH group at C-2 (gibbane numbering).
Gibberellin A40
Gibberellin a51 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 is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a51 can be found in a number of food items such as pepper (c. baccatum), mugwort, garlic, and common cabbage, which makes gibberellin a51 a potential biomarker for the consumption of these food products. Found in immature seeds of Pisum sativum (pea)
Trichothecin
A trichothecene mycototoxin isolated from the endophytic fungus Trichothecium sp. and it exhibits anti-cancer properties. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
Gibberellin A51
Gibberellin A51 (GA51) 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. Thus, gibberellin A51 is considered to be an isoprenoid lipid molecule. Gibberellin A51 is found in apple. Gibberellin A51 is found in immature seeds of Pisum sativum (pea). Found in immature seeds of Pisum sativum (pea)
(R)-Marmin
(R)-Marmin is found in citrus. (R)-Marmin is a constituent of grapefruit peel and bael fruit (Aegle marmelos)
Gibberellin A45
Gibberellin A45 (GA45) 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 A45 is found in apple. Gibberellin A45 is a constituent of Pyrus communis (pear). Constituent of Pyrus communis (pear). Gibberellin A45 is found in many foods, some of which are pomes, sunflower, apple, and pear.
Gibberellin A70
Gibberellin A70 (GA70) 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 A70 is a constituent of immature Prunus persica (peach) seeds. Constituent of immature Prunus persica (peach) seeds. Gibberellin A70 is found in apple, fruits, and okra.
Gibberellin A61
Gibberellin A61 (GA61) 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 A61 is a constituent of Triticum aestivum (wheat). Constituent of Triticum aestivum (wheat). Gibberellin A61 is found in many foods, some of which are cereals and cereal products, peach, apple, and loquat.
Gibberellin A4
Gibberellin a4 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 a4 is slightly soluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a4 can be found in a number of food items such as passion fruit, dandelion, mamey sapote, and vanilla, which makes gibberellin a4 a potential biomarker for the consumption of these food products. D006133 - Growth Substances > D010937 - Plant Growth Regulators > D005875 - Gibberellins
Gibberellin A20
Gibberellin a20 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 a20 is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Gibberellin a20 can be found in a number of food items such as soursop, nopal, breadnut tree seed, and red huckleberry, which makes gibberellin a20 a potential biomarker for the consumption of these food products.
ArnicolideD
Arnicolide D is a sesquiterpene lactone. Arnicolide D is a natural product found in Centipeda minima, Arnica montana, and Arnica acaulis with data available. Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima. Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways. Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner[1]. Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima. Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways. Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner[1]. Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima. Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways. Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner[1].
[1aR-(1aalpha,3alpha,4beta,4abeta,5beta,9aS*)]- 1a,2,4,4a,5,9-Hexahydro-5-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester 2-methyl-2-propenoic acid
asperfuranone
A member of the class of 2-benzofurans that is 6,7-dihydro-2-benzofuran-4(5H)-one that is substituted at positions 5 and 6 by hydroxy groups, at position 5 by a methyl group and at position 1 by a (2E,4E,6S)-4,6-dimethylocta-2,4-dienoyl group (the 5S,6R-diastereoisomer). A polyketide that was first obtained from the fungus Aspergillus nidulans by using a genomic mining approach.
7,8-dihydroxy-3-[(1E,3E)-7-hydroxy-3,5-dimethylhepta-1,3-dienyl]-7-methyl-8H-isochromen-6-one
11alpha,13-dihydro-8alpha-methacryloyloxyzaluzanine C
1beta-1,12-Deacetoxy-6,9,11,-eremophilatrien-8-one
8alpha-methacryloyloxy-4beta,5alpha-epoxy-trans-germacra-1(10)-en-12,6beta-olide
(+)-(3S*,4S*,5R*)-(E)-4-hydroxy-3-isovaleroyloxy-2-(hexa-2,4-diynyliden)-1,6-dioxaspiro<4,5>decane|(+)-(3S*,4S*,5R*)-(E)-4-hydroxy-3-isovaleroyloxy-2-(hexa-2,4-diynyliden)-1,6-dioxaspiro[4,5]decane|(+)-(3S*,4S*,5R*)-(E)-4-hydroxy-3-isovaleroyloxy-2-(hexa-2,4-diynylidene)-1,6-dioxaspiro[4,5]decane
6beta-Angeloyloxy-4alpha-hydroxy-9-oxo-furano-eremophilon
1beta,10beta-epoxy-6beta-{[2-(hydroxymethyl)prop-2-enoyl]oxy}furanoeremophilane|1beta,10beta-Epoxy-furanoeremophilan-6beta-yl-(2-hydroxy-methyl-prop-2-enoat)|1beta,10beta-Epoxy-furanoeremophilan-6beta-yl-<2-hydroxy-methyl-prop-2-enoat>
3,6,8-trihydroxy-3-[3,5-dimethyl-2-oxo-3(E)-heptenyl]-2,3-dihydronaphthalen-1(4H)-one
4alpha-Hydroxy-6beta-(2-methylacryloyloxy)-9-oxofuranoeremophilon
methyl-3-prenyl-4-O-(beta-hydroxybutyryl)-coumarate
5,7-Dihydroxy-8-(2-mehtyl-1-oxobutyl)-4-pentyl-2H-1-benzopyran-4-one|5,7-dihydroxy-8-(2-methyl-butyryl)-4-pentyl-chromen-2-one|5,7-dihydroxy-8-(2-methylbutyryl)-4-pentylcoumarin|mammea C/OB
8alpha-isobutyryloxy-9-oxo-germacra-4E,1(10)Z-dien-6beta,12-olide
(4S,8R,9R,10S,12S)-15,16-epoxy-4,18-dihydroxy-19-nor-neocleroda-5,13(16),14-trien-20,12-olide|teupolin VIII
4,6-Dihydroxy-3-[3-methyl-2-butenyl]-5-[4-hydroxy-3-methyl-2-butenyl]-cinnamic acid
2-Methoxy-4-[2-[2-hydroxy-3-methoxy-5-(3-hydroxypropyl)phenyl]ethyl]phenol
11alpha,13-dihydro-3beta-methacryloyloxyzaluzanine C
3alpha,4alpha-Epoxy-2alpha-isobutyryloxykauniolide
2-(1-Methoxy-3-phenylpropyl)-3,5,6-trimethoxyphenol
3-hydroxy-nagilactone F|3beta-hydroxynagilactone F
6-(2,3-dihydroxy-3-methylbutyl)-8-prenylumbelliferone
(1S,5R,10R,7E,11Z)-5-hydroxy-1-isopropenyl-3,6-dioxocyclotetradeca-8-methyl-7,11-dien-10,12-carbolactone|gyrosanolide D
1EC,10EC-Epoxy-6EC-isobutyryloxy-9-oxofuranoeremophilane
1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutane-2,3-diol
4-[3,5-dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol
C19H24O5_6H-2-Benzopyran-6-one, 7,8-dihydro-7,8-dihydroxy-3-[(1E,3E)-7-hydroxy-3,5-dimethyl-1,3-heptadien-1-yl]-7-methyl
C19H24O5_2-Propenoic acid, 2-methyl-, (3S,3aR,4S,4aR,7aR,8R,9aR)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-3,4a,8-trimethyl-2,5-dioxoazuleno[6,5-b]furan-4-yl ester
Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima. Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways. Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner[1]. Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima. Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways. Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner[1]. Arnicolide D is a sesquiterpene lactone isolated from Centipeda minima. Arnicolide D modulates the cell cycle, activates the caspase signaling pathway and inhibits the PI3K/AKT/mTOR and STAT3 signaling pathways. Arnicolide D inhibits Nasopharyngeal carcinoma (NPC) cell viability in a concentration- and time-dependent manner[1].
1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutane-2,3-diol
1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutane-2,3-diol [IIN-based: Match]
1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutane-2,3-diol [IIN-based on: CCMSLIB00000848242]
7,8-dihydroxy-3-[(1E,3E)-7-hydroxy-3,5-dimethylhepta-1,3-dienyl]-7-methyl-8H-isochromen-6-one_major
1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutane-2,3-diol_major
7,8-dihydroxy-3-[(1E,3E)-7-hydroxy-3,5-dimethylhepta-1,3-dienyl]-7-methyl-8H-isochromen-6-one_85.7\\%
1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methylbutane-2,3-diol_56.5\\%
7,8-dihydroxy-3-[(1E,3E)-7-hydroxy-3,5-dimethylhepta-1,3-dienyl]-7-methyl-8H-isochromen-6-one_minor
Gibberellin A61
Gibberellin A45
Gibberellin A70
1-[2-Hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]-3-methyl-2,3-butanediol
KW-2449
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor
(1aR,4S,4aS,5S,9aS)-4,4a,6-Trimethyl-9-oxo-2,3,4,4a,5,9-hexahydro-1aH-oxireno[8,8a]naphtho[2,3-b]furan-5-yl 2-methylpropanoate
A natural product found in Pittocaulon velatum.
4-(6-Methyl-4-phenylquinazolin-2-yl)piperazine-1-carbaldehyde
(2E,3E)-2-((((R)-4-Methyl-5-oxo-2,5-dihydrofuran-2-yl)oxy)methylene)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-enoic acid
4-Hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
4-[3,5-Dihydroxy-7-(4-hydroxyphenyl)heptyl]benzene-1,2-diol
CID 11681509
D006133 - Growth Substances > D010937 - Plant Growth Regulators > D005875 - Gibberellins
[(1S,2R,3R,5S,12R)-1,2,6-trimethylspiro[4,9-dioxatetracyclo[8.2.1.02,8.03,5]tridec-6-ene-13,2-oxirane]-12-yl] (Z)-but-2-enoate
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
(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]heptadecane-9-carboxylic acid
(1R,2R,5R,8R,9S,10R,11S,13S)-13-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
(1R,2R,5R,8R,9S,10R,11S,13R)-13-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
(1R,2R,5R,8R,9S,10R,11S)-11-methyl-16-oxospiro[15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-6,2-oxirane]-9-carboxylic acid
(2R,5R,6R,8R,9S,10R,11S)-11-methyl-16-oxospiro[15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-6,2-oxirane]-9-carboxylic acid
CID 12304146
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
3-(5,7-Diphenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-1-propanol
(1S,2R,4aR,4bR,7R,9aR,10S,10aR)-2-hydroxy-1-methyl-8-methylidene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
2-[(Z)-2,4-Hexadiynylidene]-3-isovaleryloxy-1,6-dioxaspiro[4.5]decan-4-ol
(1s,2s,3s,4s,5s,12r)-5-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadec-8-ene-2,4-dicarboxylic acid
(1s,3r,9s,13s)-1-methyl-9-(prop-1-en-2-yl)-4,16-dioxatricyclo[11.2.1.1³,⁶]heptadec-6(17)-ene-5,11,14-trione
3-[2,4-dihydroxy-3-(4-hydroxy-3-methylbut-2-en-1-yl)-5-(3-methylbut-2-en-1-yl)phenyl]prop-2-enoic acid
5-[(2r,3s)-4-(4-hydroxy-3-methoxyphenyl)-3-methylbutan-2-yl]-3-methoxybenzene-1,2-diol
(3ar,4s,11ar)-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylprop-2-enoate
(1's,2r,2'r,7'r,9'r,11'r)-1',2',5'-trimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl (2z)-but-2-enoate
1',2',5'-trimethyl-4'-oxo-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl but-2-enoate
6a-hydroxy-9-methyl-3,6-dimethylidene-2-oxo-3ah,4h,5h,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylpropanoate
(1r,2s,3s,4s,5s,9s,12r)-5-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.0¹,⁹.0³,⁸]pentadec-7-ene-2,4-dicarboxylic acid
(3s,3ar,4s,6ar,8s,9ar,9br)-8-hydroxy-3-methyl-6,9-dimethylidene-2-oxo-octahydro-3h-azuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
5,7-dihydroxy-8-(3-methylbutanoyl)-4-pentylchromen-2-one
(3ar,4r,6as,9ar,9bs)-6a-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylpropanoate
(1r,2r,4r,5'r,8as)-5'-(furan-3-yl)-4-hydroxy-5-(hydroxymethyl)-2-methyl-3,4,6,7,8,8a-hexahydro-2h-spiro[naphthalene-1,3'-oxolan]-2'-one
5'-(furan-3-yl)-4-hydroxy-5-(hydroxymethyl)-2-methyl-3,4,6,7,8,8a-hexahydro-2h-spiro[naphthalene-1,3'-oxolan]-2'-one
7-{[(2e,6r)-6,7-dihydroxy-3,7-dimethyloct-2-en-1-yl]oxy}chromen-2-one
2-(hexa-2,4-diyn-1-ylidene)-4-hydroxy-1,6-dioxaspiro[4.5]decan-3-yl 3-methylbutanoate
methyl 4-{[(2e)-3,7-dimethyl-5-oxoocta-2,6-dien-1-yl]oxy}-3-methoxybenzoate
8-(2,3-dihydroxy-3-methylbutyl)-7-[(3-methylbut-2-en-1-yl)oxy]chromen-2-one
6a-hydroxy-3,6,9-trimethylidene-2-oxo-hexahydro-3ah-azuleno[4,5-b]furan-8-yl 2-methylpropanoate
2-[(2s,3r)-3-(acetyloxy)-5,8-dimethyl-4-oxo-2,3-dihydro-1h-naphthalen-2-yl]propan-2-yl acetate
(1r,2r,4r,5r,8r,9s,10r,11r)-4-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid
(3ar,4s,6ar,7s,9ar,9br)-4-hydroxy-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-7-yl 2-methylpropanoate
(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-methylpropanoate
(1r,2r,5r,8r,9s,10r,11r,14s)-14-hydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadecane-9-carboxylic acid
[(3as,8s,9ar,9bs)-8-hydroxy-3,9-dimethylidene-2-oxo-3ah,4h,5h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-6-yl]methyl 2-methylpropanoate
3,5-dihydroxy-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane
{"Ingredient_id": "HBIN007607","Ingredient_name": "3,5-dihydroxy-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane","Alias": "NA","Ingredient_formula": "C19H24O5","Ingredient_Smile": "C1=CC(=CC=C1CCC(CC(CCC2=CC(=C(C=C2)O)O)O)O)O","Ingredient_weight": "332.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5814","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "636849","DrugBank_id": "NA"}
4,6-dihydroxy-3-[3'-me thyl-2'-butenyl]-5-[4''-hydroxy-3''-methyl-2''-butenyl]-cinnamicacid
{"Ingredient_id": "HBIN010072","Ingredient_name": "4,6-dihydroxy-3-[3'-me thyl-2'-butenyl]-5-[4''-hydroxy-3''-methyl-2''-butenyl]-cinnamicacid","Alias": "NA","Ingredient_formula": "C19H24O5","Ingredient_Smile": "CC(=CCC1=C(C(=C(C(=C1)C=CC(=O)O)O)CC=C(C)CO)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6022","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
aguerin A
{"Ingredient_id": "HBIN014918","Ingredient_name": "aguerin A","Alias": "NA","Ingredient_formula": "C19H24O5","Ingredient_Smile": "CC(C)C(=O)OC1CC(=C)C2CC(C(=C)C2C3C1C(=C)C(=O)O3)O","Ingredient_weight": "332.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32644","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "354589","DrugBank_id": "NA"}