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CHEBI:222512 - (-)-ethyl homononactate

ChEBI IDCHEBI:222512
ChEBI Name(-)-ethyl homononactate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24O4
Net Charge0
Average Mass244.331
Monoisotopic Mass244.16746
SMILESCCOC(=O)[C@H](C)[C@H]1CC[C@@H](C[C@@H](O)CC)O1
InChIInChI=1S/C13H24O4/c1-4-10(14)8-11-6-7-12(17-11)9(3)13(15)16-5-2/h9-12,14H,4-8H2,1-3H3/t9-,10+,11+,12-/m1/s1
InChIKeyKJHMFBXSFYEECB-NOOOWODRSA-N
Species of MetaboliteComponentSourceComments
Bacillus pumilus (ncbitaxon:1408) - PubMed (25044594)
ChEBI Ontology
Outgoing Relation(s)
(-)-ethyl homononactate (CHEBI:222512) is a oxolanes (CHEBI:26912)
IUPAC Name 
ethyl (2R)-2-[(2R,5S)-5-[(2S)-2-hydroxybutyl]oxolan-2-yl]propanoate
Manual XrefsDatabases
78438243ChemSpider