EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:203587 - Alcanivorone

ChEBI IDCHEBI:203587
ChEBI NameAlcanivorone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O5
Net Charge0
Average Mass210.185
Monoisotopic Mass210.05282
SMILESC/C(=C/c1cc(O)c(=O)oc1C)C(=O)O
InChIInChI=1S/C10H10O5/c1-5(9(12)13)3-7-4-8(11)10(14)15-6(7)2/h3-4,11H,1-2H3,(H,12,13)/b5-3-
InChIKeyQKBSCLLKTULFMG-HYXAFXHYSA-N
Species of MetaboliteComponentSourceComments
Alcanivorax jadensis (ncbitaxon:64988) - PubMed (18408325)
ChEBI Ontology
Outgoing Relation(s)
Alcanivorone (CHEBI:203587) is a pyranone (CHEBI:37963)
IUPAC Name 
(Z)-3-(5-hydroxy-2-methyl-6-oxopyran-3-yl)-2-methylprop-2-enoic acid
Manual XrefsDatabases
8528500ChemSpider