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CHEBI:205552 - Phaeolschidin C

ChEBI IDCHEBI:205552
ChEBI NamePhaeolschidin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H24O12
Net Charge0
Average Mass576.510
Monoisotopic Mass576.12678
SMILESO=C(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/C30H24O12/c31-20-8-3-15(11-22(20)33)1-5-17-13-24(35)27(29(39)41-17)19(7-10-26(37)38)28-25(36)14-18(42-30(28)40)6-2-16-4-9-21(32)23(34)12-16/h1-6,8-9,11-14,19,31-36H,7,10H2,(H,37,38)/b5-1+,6-2+
InChIKeyBAUBFAJHDIHNIK-IJIVKGSJSA-N
Species of MetaboliteComponentSourceComments
Phaeolus schweinitzii (ncbitaxon:40476) - PubMed (23869482)
ChEBI Ontology
Outgoing Relation(s)
Phaeolschidin C (CHEBI:205552) is a catechols (CHEBI:33566)
IUPAC Name 
4,4-bis[6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-yl]butanoic acid
Manual XrefsDatabases
30823714ChemSpider