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CHEBI:202343 - Phlebiachrysoic acid A

ChEBI IDCHEBI:202343
ChEBI NamePhlebiachrysoic acid A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H30O6
Net Charge0
Average Mass390.476
Monoisotopic Mass390.20424
SMILESCOC1=CC(=O)C(O)=C(CCCCCCC/C=C\CCC/C=C/C(=O)O)C1=O
InChIInChI=1S/C22H30O6/c1-28-19-16-18(23)21(26)17(22(19)27)14-12-10-8-6-4-2-3-5-7-9-11-13-15-20(24)25/h3,5,13,15-16,26H,2,4,6-12,14H2,1H3,(H,24,25)/b5-3-,15-13+
InChIKeyDSDOWUKLOBXSHI-QQPYNVQXSA-N
Species of MetaboliteComponentSourceComments
Crustodontia chrysocreas (ncbitaxon:2716695) - DOI (10.1002/jlac.199719970207)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Phlebiachrysoic acid A (CHEBI:202343) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(2E,7Z)-15-(2-hydroxy-5-methoxy-3,6-dioxocyclohexa-1,4-dien-1-yl)pentadeca-2,7-dienoic acid
Manual XrefsDatabases
10268640ChemSpider