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CHEBI:203782 - Gallicynoic acid H

ChEBI IDCHEBI:203782
ChEBI NameGallicynoic acid H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC16H28O4
Net Charge0
Average Mass284.396
Monoisotopic Mass284.19876
SMILESCCCC[C@@H](O)C#C[C@@H](O)CCCCCCCC(=O)O
InChIInChI=1S/C16H28O4/c1-2-3-9-14(17)12-13-15(18)10-7-5-4-6-8-11-16(19)20/h14-15,17-18H,2-11H2,1H3,(H,19,20)/t14-,15+/m1/s1
InChIKeyVAEJVKIWYRYFDG-CABCVRRESA-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 H (CHEBI:203782) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
(9S,12R)-9,12-dihydroxyhexadec-10-ynoic acid
Manual XrefsDatabases
78440967ChemSpider