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CHEBI:199680 - Berkedienoic acid

Default Structure
ChEBI IDCHEBI:199680
ChEBI NameBerkedienoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O3
Net Charge0
Average Mass196.246
Monoisotopic Mass196.10994
SMILESC=C/C=C/[C@@H](O)C/C(=C\CC)C(=O)O
InChIInChI=1S/C11H16O3/c1-3-5-7-10(12)8-9(6-4-2)11(13)14/h3,5-7,10,12H,1,4,8H2,2H3,(H,13,14)/b7-5+,9-6+/t10-/m1/s1
InChIKeySSSYMZDZKBTBDM-QAWGYZMXSA-N
Species of MetaboliteComponentSourceComments
Talaromyces ruber (ncbitaxon:1266769) - PubMed (22295871)
ChEBI Ontology
Outgoing Relation(s)
Berkedienoic acid (CHEBI:199680) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(2E,5E)-4-hydroxy-2-propylideneocta-5,7-dienoic acid
Manual XrefsDatabases
75127309ChemSpider