EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:10448 - beta-Vetivone

ChEBI IDCHEBI:10448
ChEBI Namebeta-Vetivone
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H22O
Net Charge0
Average Mass218.340
Monoisotopic Mass218.16707
SMILESCC1=CC(=O)C[C@@H](C)[C@]12CCC(=C(C)C)C2
InChIInChI=1S/C15H22O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12H,5-6,8-9H2,1-4H3/t12-,15+/m1/s1
InChIKeyISLOGSAEQNKPGG-DOMZBBRYSA-N
ChEBI Ontology
Outgoing Relation(s)
beta-Vetivone (CHEBI:10448) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
beta-VetivoneKEGG COMPOUND
Manual XrefsDatabases
C09745KEGG COMPOUND
C00003199KNApSAcK
Registry NumbersSources
CAS:18444-79-6KEGG COMPOUND