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CHEBI:192919 - Daidzein 6''-O-acetate

ChEBI IDCHEBI:192919
ChEBI NameDaidzein 6''-O-acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H22O10
Net Charge0
Average Mass458.419
Monoisotopic Mass458.12130
SMILESCC(=O)OCC1O[C@@H](Oc2ccc3c(=O)c(-c4ccc(O)cc4)coc3c2)C(O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C23H22O10/c1-11(24)30-10-18-20(27)21(28)22(29)23(33-18)32-14-6-7-15-17(8-14)31-9-16(19(15)26)12-2-4-13(25)5-3-12/h2-9,18,20-23,25,27-29H,10H2,1H3/t18?,20-,21+,22?,23-/m1/s1
InChIKeyZMOZJTDOTOZVRT-ZLXZQHNHSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS3183) Strain: Cryptomeria fortunei Hooibrenk
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
EC 1.14.18.1 (tyrosinase) inhibitor  Any EC 1.14.18.* (oxidoreductase acting on paired donors, miscellaneous compound as one donor, incorporating 1 atom of oxygen) inhibitor that interferes with the action of tyrosinase (monophenol monooxygenase), EC 1.14.18.1, an enzyme that catalyses the oxidation of phenols (such as tyrosine) and is widespread in plants and animals.
ChEBI Ontology
Outgoing Relation(s)
Daidzein 6''-O-acetate (CHEBI:192919) is a acrovestone (CHEBI:2440)
Daidzein 6''-O-acetate (CHEBI:192919) is a isoflavonoid (CHEBI:50753)
IUPAC Name 
[(3S,4S,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate
Manual XrefsDatabases
LMPK12050015LIPID MAPS
24842688ChemSpider