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CHEBI:208869 - Aspinonene

ChEBI IDCHEBI:208869
ChEBI NameAspinonene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H16O4
Net Charge0
Average Mass188.223
Monoisotopic Mass188.10486
SMILESC[C@H](O)/C=C/C(O)(CO)[C@@H]1O[C@H]1C
InChIInChI=1S/C9H16O4/c1-6(11)3-4-9(12,5-10)8-7(2)13-8/h3-4,6-8,10-12H,5H2,1-2H3/b4-3+/t6-,7-,8+,9?/m0/s1
InChIKeyZXCYAEKEHIEQHD-LHVSAYPMSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1002/jlac.199419940812)
ChEBI Ontology
Outgoing Relation(s)
Aspinonene (CHEBI:208869) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(E,5S)-2-[(2R,3S)-3-methyloxiran-2-yl]hex-3-ene-1,2,5-triol
Manual XrefsDatabases
78437376ChemSpider