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CHEBI:205222 - Gallicynoic acid C

ChEBI IDCHEBI:205222
ChEBI NameGallicynoic acid C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26O4
Net Charge0
Average Mass282.380
Monoisotopic Mass282.18311
SMILESCCCC[C@@H](O)C#C[C@@H](O)/C=C\CCCCCC(=O)O
InChIInChI=1S/C16H26O4/c1-2-3-9-14(17)12-13-15(18)10-7-5-4-6-8-11-16(19)20/h7,10,14-15,17-18H,2-6,8-9,11H2,1H3,(H,19,20)/b10-7-/t14-,15+/m1/s1
InChIKeyIJBTXFFPFVNDAG-FZXWVIKQSA-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 C (CHEBI:205222) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(Z,9S,12R)-9,12-dihydroxyhexadec-7-en-10-ynoic acid
Manual XrefsDatabases
78441044ChemSpider