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CHEBI:225410 - Gallicynoic acid E

ChEBI IDCHEBI:225410
ChEBI NameGallicynoic acid E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H30O5
Net Charge0
Average Mass326.433
Monoisotopic Mass326.20932
SMILESCCCCC(O)C#CC(O)/C=C\CCCCCC(O)CC(=O)O
InChIInChI=1S/C18H30O5/c1-2-3-9-15(19)12-13-16(20)10-7-5-4-6-8-11-17(21)14-18(22)23/h7,10,15-17,19-21H,2-6,8-9,11,14H2,1H3,(H,22,23)/b10-7-
InChIKeyIRDUBXGVWQSMKQ-YFHOEESVSA-N
Species of MetaboliteComponentSourceComments
Coriolopsis gallica (ncbitaxon:76126) - PubMed (18247526)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Gallicynoic acid E (CHEBI:225410) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(Z)-3,11,14-trihydroxyoctadec-9-en-12-ynoic acid
Manual XrefsDatabases
78444673ChemSpider