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CHEBI:225831 - Diapolic acid B

Default Structure
ChEBI IDCHEBI:225831
ChEBI NameDiapolic acid B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H16O3
Net Charge0
Average Mass172.224
Monoisotopic Mass172.10994
SMILESCCC[C@H](O)CC/C=C/C(=O)O
InChIInChI=1S/C9H16O3/c1-2-5-8(10)6-3-4-7-9(11)12/h4,7-8,10H,2-3,5-6H2,1H3,(H,11,12)/b7-4+/t8-/m0/s1
InChIKeyANOHTLNVRMZIMW-IPWDFOCMSA-N
Species of MetaboliteComponentSourceComments
Diaporthe terebinthifolii (ncbitaxon:1303642) - PubMed (27599766)
ChEBI Ontology
Outgoing Relation(s)
Diapolic acid B (CHEBI:225831) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(E)-6-hydroxynon-2-enoic acid
Manual XrefsDatabases
78435185ChemSpider