EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:178564 - Auriculasin

ChEBI IDCHEBI:178564
ChEBI NameAuriculasin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H24O6
Net Charge0
Average Mass420.461
Monoisotopic Mass420.15729
SMILESCC(C)=CCc1c2c(c(O)c3c(=O)c(-c4ccc(O)c(O)c4)coc13)C=CC(C)(C)O2
InChIInChI=1S/C25H24O6/c1-13(2)5-7-16-23-15(9-10-25(3,4)31-23)21(28)20-22(29)17(12-30-24(16)20)14-6-8-18(26)19(27)11-14/h5-6,8-12,26-28H,7H2,1-4H3
InChIKeyPSEBCAMYGWGJMH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Auriculasin (CHEBI:178564) is a isoflavanones (CHEBI:38741)
IUPAC Name 
7-(3,4-dihydroxyphenyl)-5-hydroxy-2,2-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-g]chromen-6-one
Manual XrefsDatabases
4513925ChemSpider
LMPK12050247LIPID MAPS