EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:175546 - Gancaonin C

ChEBI IDCHEBI:175546
ChEBI NameGancaonin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O6
Net Charge0
Average Mass354.358
Monoisotopic Mass354.11034
SMILESC/C(=C\Cc1c(O)cc(O)c2c(=O)c(-c3ccc(O)cc3)coc12)CO
InChIInChI=1S/C20H18O6/c1-11(9-21)2-7-14-16(23)8-17(24)18-19(25)15(10-26-20(14)18)12-3-5-13(22)6-4-12/h2-6,8,10,21-24H,7,9H2,1H3/b11-2+
InChIKeyMEADLGUPYQNUNF-BIIKFXOESA-N
ChEBI Ontology
Outgoing Relation(s)
Gancaonin C (CHEBI:175546) is a isoflavones (CHEBI:38757)
IUPAC Name 
5,7-dihydroxy-8-[(E)-4-hydroxy-3-methylbut-2-enyl]-3-(4-hydroxyphenyl)chromen-4-one
Manual XrefsDatabases
LMPK12050197LIPID MAPS
HMDB0038395HMDB
4953490ChemSpider
Registry NumbersSources
CAS:124596-87-8ChemIDplus