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CHEBI:173153 - Panaquinquecol 2

ChEBI IDCHEBI:173153
ChEBI NamePanaquinquecol 2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O3
Net Charge0
Average Mass276.376
Monoisotopic Mass276.17254
SMILESC=CC(O)C#CC#CC(O)C1OC1CCCCCCC
InChIInChI=1S/C17H24O3/c1-3-5-6-7-8-13-16-17(20-16)15(19)12-10-9-11-14(18)4-2/h4,14-19H,2-3,5-8,13H2,1H3
InChIKeyUJQVRPFUQYYCTH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) feces (BTO:0000440) MetaboLights (MTBLS2721)
ChEBI Ontology
Outgoing Relation(s)
Panaquinquecol 2 (CHEBI:173153) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
1-(3-heptyloxiran-2-yl)oct-7-en-2,4-diyne-1,6-diol
Manual XrefsDatabases
LMFA05000687LIPID MAPS
34551892ChemSpider
HMDB0038938HMDB