EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:175112 - Glabrene

ChEBI IDCHEBI:175112
ChEBI NameGlabrene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O4
Net Charge0
Average Mass322.360
Monoisotopic Mass322.12051
SMILESCC1(C)C=Cc2c(O)ccc(C3=Cc4ccc(O)cc4OC3)c2O1
InChIInChI=1S/C20H18O4/c1-20(2)8-7-16-17(22)6-5-15(19(16)24-20)13-9-12-3-4-14(21)10-18(12)23-11-13/h3-10,21-22H,11H2,1-2H3
InChIKeyNGGYSPUAKQMTNP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Glabrene (CHEBI:175112) is a isoflavonoid (CHEBI:50753)
IUPAC Name 
8-(7-hydroxy-2H-chromen-3-yl)-2,2-dimethylchromen-5-ol
Manual XrefsDatabases
421858ChemSpider
HMDB0029530HMDB
Registry NumbersSources
CAS:60008-03-9ChemIDplus