Chemical Formula: C18H22O5
Chemical Formula C18H22O5
Found 171 metabolite its formula value is C18H22O5
(S,E)-Zearalenone
CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4903; ORIGINAL_PRECURSOR_SCAN_NO 4902 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4907; ORIGINAL_PRECURSOR_SCAN_NO 4903 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4915; ORIGINAL_PRECURSOR_SCAN_NO 4913 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4892; ORIGINAL_PRECURSOR_SCAN_NO 4888 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4889; ORIGINAL_PRECURSOR_SCAN_NO 4888 CONFIDENCE standard compound; INTERNAL_ID 211; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4992; ORIGINAL_PRECURSOR_SCAN_NO 4988 Fungal metabolite of Fusarium subspecies and of Gibberella zeae. Potential food mycotoxin. Has weak estrogenic activity and causes physiol. changes when ingested by animals as foodstuffs contaminant. (S,E)-Zearalenone is found in corn. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens Acquisition and generation of the data is financially supported in part by CREST/JST. D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2248 cis-Zearalenone is a metabolite of Fusarium species. Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2]. Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2].
2-Hydroxyenterodiol
2-Hydroxyenterodiol is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
4-Hydroxyenterodiol
4-Hydroxyenterodiol is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
6-Hydroxyenterodiol
6-Hydroxyenterodiol is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
[(3-Hexyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetic acid
Erianin
Erianin, often used as an antipyretic and analgesic agent, could inhibit IDO-induced tumor angiogenesis. Erianin, often used as an antipyretic and analgesic agent, could inhibit IDO-induced tumor angiogenesis.
(11S)-11-Methyl-15,17-bis(oxidanyl)-12-oxabicyclo[12.4.0]octadeca-1(18),2,14,16-tetraene-7,13-dione
Phenol
Erianin is a natural product found in Dendrobium thyrsiflorum and Dendrobium chrysotoxum with data available. Erianin, often used as an antipyretic and analgesic agent, could inhibit IDO-induced tumor angiogenesis. Erianin, often used as an antipyretic and analgesic agent, could inhibit IDO-induced tumor angiogenesis.
Laurycolactone A
Laurycolactone A is a natural product found in Eurycoma longifolia with data available.
Gerin
2-[6-acetyl-2,3-dihydro-5-hydroxybenzofuran-2-yl]prop-2-enyl 3-methylbutanoate
1-isobutyryyloxy-2-(E-3-methyloxiranyl)-4-angelyloxybenzene
3,5-dihydroxy-2-(1-oxoocta-2E,4E-dienyl)benzeneacetic acid ethyl ester|cytosporone F
Desacylcynaropicrin-(alpha-methacrylat)|Desacylcynaropicrin-
3-(8S*-hydroxynona-5-E-enyl)-6,8-dihydroxyisochromen-1-one|fusariumin
Griffithane A
A dimethoxybenzene that is 2,5-dimethoxyphenol substituted by a 3-(4-hydroxy-3-methoxyphenyl)propyl group at position 4. It has been isolated from the stems of Combretum griffithii and has been shown to exhibit anticancer activity.
Griffithane B
A dimethoxybenzene that is 2,6-dimethoxyphenol substituted by a 3-(4-hydroxy-3-methoxyphenyl)propyl group at position 3. It has been isolated from the stems of Combretum griffithii and has been shown to exhibit anticancer activity.
Griffithane C
A member of the class of catechols that is benzene-1,2-diol substituted by a methoxy group at position 5 and a 3-(3,4-dimethoxyphenyl)propyl group at position 4. It has been isolated from the stems of Combretum griffithii.
(R)-(+)-2-(3-hydroxy-3-phenylpropyl)-3,5,6-trimethoxyphenol|welwitschin C
(Z)-methyl 2-((1aS,1bR,5S,5aR,6aR)-5-acetoxy-1b-methyl-6-methylene-3-oxooctahydrocyclopropa [a]inden-4(1bH)-ylidene)propanoate|linderolide L
schomburgbiphenyl|[1,1-biphenyl]-2-(3-hydroxy-3-methylbutyl)-3-methoxy-4,4,5-triol
Erianin
Erianin is a natural product found in Dendrobium thyrsiflorum and Dendrobium chrysotoxum with data available. Erianin, often used as an antipyretic and analgesic agent, could inhibit IDO-induced tumor angiogenesis. Erianin, often used as an antipyretic and analgesic agent, could inhibit IDO-induced tumor angiogenesis.
1beta,14-dihydroxy-13-methoxy-8,11,13-podocarpatriene-2,7-dione|1??,14-Dihydroxy-13-methoxy-8,11,13-podocarpatriene-2,7-dione
(R)-3,4-dihydroxy-5,4,alpha-trimethoxybibenzyl|dendrocandin A
2-Methyl-2-(4-methyl-3-pentenyl)-5,7-dihydroxy-2H-1-benzopyran-6-carboxylic acid methyl ester
3-(1,1-Dimethylallyl)-6-dimethoxymethyl-7-methoxy-cumarin|6-dimethoxymethyl-3-(1,1-dimethyl-allyl)-7-methoxy-chromen-2-one
1-angelyloxy-2-(E-3-methyloxiranyl)-4-isobutyryloxybenzene
(1aR,4S,4aS,5S,9aS)-2,3,4,4a,5,9-hexahydro-4,4a,6-trimethyl-9-oxo-1aH-oxireno[8,8a]naphtho[2,3-b]furan-5-yl propanoate|1beta,10beta-epoxy-6beta-(propanoyloxy)furanoeremophilan-9-one
Zearalenone
A macrolide comprising a fourteen-membered lactone fused to 1,3-dihydroxybenzene; a potent estrogenic metabolite produced by some Giberella species. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE standard compound; INTERNAL_ID 5970 Origin: Microbe; Formula(Parent): C18H22O5; Bottle Name:zearalenone; PRIME Parent Name:Zearalenone; PRIME in-house No.:V0033 CONFIDENCE Reference Standard (Level 1) Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2]. Zearalenone is a mycotoxin produced mainly by fungi belonging to the genus Fusarium in foods and feeds. Possess oestrogenic activity in pigs, cattle and sheep, with low acute toxicity. Causes precocious development of mammae and other estrogenic effects in young gilts[1][2].
C18H22O5_1H-2-Benzoxacyclotetradecin-1,7(8H)-dione, 3,4,5,6,9,10-hexahydro-14,16-dihydroxy-3-methyl-, (11E)
1H-2-Benzoxacyclotetradecin-1-one, 3,4,5,6,7,8,9,10-octahydro-14,16-dihydroxy-3-methyl-7-oxo-, (E)-
2-Hydroxyenterodiol
4-Hydroxyenterodiol
6-Hydroxyenterodiol
Benzene,1,1-[oxybis(methylene)]bis[3,4-dimethoxy- (9CI)
2-Naphthalenecarboxylic acid, 4,6,7-triMethoxy-8-(1-Methylethyl)-, Methyl ester
ETHYL 4-HYDROXY-8-ISOPROPYL-6,7-DIMETHOXY-2-NAPHTHOATE
2-[1-Hydroxy-3-(4-methoxyphenyl)propyl]-3,5-dimethoxyphenol
(2Z,4Z)-2-hydroxy-4-[(3aS,5aS,9aS,9bS)-3a-methyl-3,7-dioxododecahydro-6H-cyclopenta[a]naphthalen-6-ylidene]but-2-enoic acid
(S,E)-Zearalenone
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
(2Z,10Z)-3-hydroxy-5,17-dioxo-4,5-secoestra-2,10-diene-3-oic acid
An oxo seco-steroid that is a meta-cleavage metabolite in the estrogen degradation pathway; an unstable precursor to pyridinestrone acid.
ethyl 2-[7-hydroxy-4-oxo-2-(pent-1-en-1-yl)-2,3-dihydro-1-benzopyran-5-yl]acetate
(6ar,9s,9ar,9bs)-3,6a-dimethyl-9-[(2s)-2-methylbutanoyl]-1h,9h,9ah,9bh-furo[2,3-h]isochromene-6,8-dione
(3r,5e)-14,16-dihydroxy-3-methyl-4,7,8,9,10,12-hexahydro-3h-2-benzoxacyclotetradecine-1,11-dione
(2s)-2-(6-acetyl-5-hydroxy-1-benzofuran-2-yl)propyl 3-methylbutanoate
14,16-dihydroxy-3-methyl-4,5,6,7,8,12-hexahydro-3h-2-benzoxacyclotetradecine-1,11-dione
(1s,2r,5r,9s,10s,11r,12r,15r)-11-hydroxy-2,6,9,15-tetramethyl-13-oxatetracyclo[10.2.1.0²,¹⁰.0⁵,⁹]pentadec-6-ene-3,8,14-trione
7,10-dihydroxy-1-(hydroxymethyl)-6-methoxy-1,4a-dimethyl-3,4-dihydro-2h-phenanthren-9-one
(1s,2r,7r,8s,9s,17s)-8-hydroxy-1,17-dimethyl-12-methylidene-10,13-dioxatetracyclo[7.7.1.0²,⁷.0¹¹,¹⁵]heptadec-11(15)-ene-14,16-dione
(1s,2r,9s,11r,12r,15r)-11-hydroxy-2,6,9,15-tetramethyl-13-oxatetracyclo[10.2.1.0²,¹⁰.0⁵,⁹]pentadec-6-ene-3,8,14-trione
5-[3-(4-hydroxy-3-methoxyphenyl)propyl]-2,4-dimethoxyphenol
4a-hydroxy-3,5,8-trimethylidene-2-oxo-hexahydro-3ah-azuleno[6,5-b]furan-6-yl propanoate
6,8-dihydroxy-3-[(8s)-8-hydroxynon-5-en-1-yl]isochromen-1-one
1-(2,3-dimethoxy-5-methylphenoxy)-2,3-dimethoxy-5-methylbenzene
(4s,4as,10as)-4,8-dihydroxy-7-methoxy-1,1,4a-trimethyl-2,4,10,10a-tetrahydrophenanthrene-3,9-dione
6,9,10-trimethyl-2-oxo-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-8-yl propanoate
3-methoxy-5-[(1r)-1-methoxy-2-(4-methoxy-3-methylphenyl)ethyl]benzene-1,2-diol
(2s,3s)-1-(3-hydroxy-4-methoxyphenyl)-2-(4-methoxyphenyl)butane-1,3-diol
1β,14-dihydroxy-13-methoxy-8,11,13-podocar-patriene-2,7-dione
{"Ingredient_id": "HBIN002340","Ingredient_name": "1\u03b2,14-dihydroxy-13-methoxy-8,11,13-podocar-patriene-2,7-dione","Alias": "NA","Ingredient_formula": "C18H22O5","Ingredient_Smile": "CC1(CC(=O)C(C2(C1CC(=O)C3=C2C=CC(=C3O)OC)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5998","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}