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CHEBI:213634 - (S)-4-butoxy-6-((S)-1-hydroxypentyl)-5,6-dihydro-2H-pyran-2-one

ChEBI IDCHEBI:213634
ChEBI Name(S)-4-butoxy-6-((S)-1-hydroxypentyl)-5,6-dihydro-2H-pyran-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H24O4
Net Charge0
Average Mass256.342
Monoisotopic Mass256.16746
SMILESCCCCOC1=CC(=O)O[C@H]([C@@H](O)CCCC)C1
InChIInChI=1S/C14H24O4/c1-3-5-7-12(15)13-9-11(10-14(16)18-13)17-8-6-4-2/h10,12-13,15H,3-9H2,1-2H3/t12-,13-/m0/s1
InChIKeyJMXFQDONSSPQOG-STQMWFEESA-N
Species of MetaboliteComponentSourceComments
Diaporthe amygdali (ncbitaxon:1214568) - DOI (10.1016/j.phytol.2013.09.012)
ChEBI Ontology
Outgoing Relation(s)
(S)-4-butoxy-6-((S)-1-hydroxypentyl)-5,6-dihydro-2H-pyran-2-one (CHEBI:213634) is a pyranone (CHEBI:37963)
IUPAC Name 
(2S)-4-butoxy-2-[(1S)-1-hydroxypentyl]-2,3-dihydropyran-6-one
Manual XrefsDatabases
78438570ChemSpider