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CHEBI:207163 - 5'-O-acetylaporpinone A

ChEBI IDCHEBI:207163
ChEBI Name5'-O-acetylaporpinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H14O5
Net Charge0
Average Mass250.250
Monoisotopic Mass250.08412
SMILESCC(=O)OC[C@H](C)C#CC(CO)=C1C=CC(=O)O1
InChIInChI=1S/C13H14O5/c1-9(8-17-10(2)15)3-4-11(7-14)12-5-6-13(16)18-12/h5-6,9,14H,7-8H2,1-2H3/t9-/m1/s1
InChIKeyVEESHVLZMDBCOL-SECBINFHSA-N
Species of MetaboliteComponentSourceComments
Hexagonia (ncbitaxon:114778) - PubMed (21477823)
ChEBI Ontology
Outgoing Relation(s)
5'-O-acetylaporpinone A (CHEBI:207163) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
[6-hydroxy-2-methyl-5-(5-oxouran-2-ylidene)hex-3-ynyl] acetate