EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:192912 - Odyssic acid

Default Structure
ChEBI IDCHEBI:192912
ChEBI NameOdyssic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O3
Net Charge0
Average Mass204.225
Monoisotopic Mass204.07864
SMILESCC#CC#CC=C=CC(O)CCC(=O)O
InChIInChI=1S/C12H12O3/c1-2-3-4-5-6-7-8-11(13)9-10-12(14)15/h6,8,11,13H,9-10H2,1H3,(H,14,15)
InChIKeyJBHZDNMPKRGXNW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS3183) Strain: Cryptomeria fortunei Hooibrenk
ChEBI Ontology
Outgoing Relation(s)
Odyssic acid (CHEBI:192912) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
8257158ChemSpider