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CHEBI:169866 - Menthone 1,2-glyceryl ketal

ChEBI IDCHEBI:169866
ChEBI NameMenthone 1,2-glyceryl ketal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H24O3
Net Charge0
Average Mass228.332
Monoisotopic Mass228.17254
SMILESCC1CCC(C(C)C)C2(C1)OCC(CO)O2
InChIInChI=1S/C13H24O3/c1-9(2)12-5-4-10(3)6-13(12)15-8-11(7-14)16-13/h9-12,14H,4-8H2,1-3H3
InChIKeyZBJCYZPANVLBRK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Menthone 1,2-glyceryl ketal (CHEBI:169866) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name 
(9-methyl-6-propan-2-yl-1,4-dioxaspiro[4.5]decan-3-yl)methanol
Manual XrefsDatabases
142428ChemSpider
HMDB0036139HMDB
Registry NumbersSources
CAS:63187-91-7ChemIDplus