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CHEBI:208196 - Gallicynoic acid G

Default Structure
ChEBI IDCHEBI:208196
ChEBI NameGallicynoic acid G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H20O4
Net Charge0
Average Mass228.288
Monoisotopic Mass228.13616
SMILESCCCC[C@@H](O)C#C[C@@H](O)CCCC(=O)O
InChIInChI=1S/C12H20O4/c1-2-3-5-10(13)8-9-11(14)6-4-7-12(15)16/h10-11,13-14H,2-7H2,1H3,(H,15,16)/t10-,11+/m1/s1
InChIKeyFFERRNKFKPTEJW-MNOVXSKESA-N
Species of MetaboliteComponentSourceComments
Coriolopsis gallica (ncbitaxon:76126) - PubMed (18247526)
ChEBI Ontology
Outgoing Relation(s)
Gallicynoic acid G (CHEBI:208196) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(5S,8R)-5,8-dihydroxydodec-6-ynoic acid
Manual XrefsDatabases
28288887ChemSpider