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CHEBI:172757 - Kuwanon Y

ChEBI IDCHEBI:172757
ChEBI NameKuwanon Y
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H30O9
Net Charge0
Average Mass582.605
Monoisotopic Mass582.18898
SMILESCC1=CC(c2c(O)cc(/C=C/c3ccc(O)cc3O)cc2O)C(C(=O)c2ccc(O)cc2O)C(c2ccc(O)cc2O)C1
InChIInChI=1S/C34H30O9/c1-17-10-25(23-8-6-21(36)15-28(23)39)32(34(43)24-9-7-22(37)16-29(24)40)26(11-17)33-30(41)12-18(13-31(33)42)2-3-19-4-5-20(35)14-27(19)38/h2-9,11-16,25-26,32,35-42H,10H2,1H3/b3-2+
InChIKeyYYUHPJKWIHNMSV-NSCUHMNNSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
Kuwanon Y (CHEBI:172757) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
(2,4-dihydroxyphenyl)-[6-(2,4-dihydroxyphenyl)-2-[4-[(E)-2-(2,4-dihydroxyphenyl)ethenyl]-2,6-dihydroxyphenyl]-4-methylcyclohex-3-en-1-yl]methanone
Manual XrefsDatabases
HMDB0033296HMDB
35013582ChemSpider