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CHEBI:226467 - Phaeolschidin D

ChEBI IDCHEBI:226467
ChEBI NamePhaeolschidin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H26O12
Net Charge0
Average Mass590.537
Monoisotopic Mass590.14243
SMILESCOC(=O)CCC(c1c(O)cc(/C=C/c2ccc(O)c(O)c2)oc1=O)c1c(O)cc(/C=C/c2ccc(O)c(O)c2)oc1=O
InChIInChI=1S/C31H26O12/c1-41-27(38)11-8-20(28-25(36)14-18(42-30(28)39)6-2-16-4-9-21(32)23(34)12-16)29-26(37)15-19(43-31(29)40)7-3-17-5-10-22(33)24(35)13-17/h2-7,9-10,12-15,20,32-37H,8,11H2,1H3/b6-2+,7-3+
InChIKeyNSYGZAYOTRQSPG-YPCIICBESA-N
Species of MetaboliteComponentSourceComments
Phaeolus schweinitzii (ncbitaxon:40476) - PubMed (23869482)
ChEBI Ontology
Outgoing Relation(s)
Phaeolschidin D (CHEBI:226467) is a catechols (CHEBI:33566)
IUPAC Name 
methyl 4,4-bis[6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-yl]butanoate
Manual XrefsDatabases
30823715ChemSpider