CHEBI:171825 - 2,6-Dimethyl-5-heptenal propyleneglycol acetal

ChEBI IDCHEBI:171825
ChEBI Name2,6-Dimethyl-5-heptenal propyleneglycol acetal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H22O2
Net Charge0
Average Mass198.306
Monoisotopic Mass198.16198
SMILESCC(C)=CCCC(C)C1OCC(C)O1
InChIInChI=1S/C12H22O2/c1-9(2)6-5-7-10(3)12-13-8-11(4)14-12/h6,10-12H,5,7-8H2,1-4H3
InChIKeyUVCDCGGGCGCIRU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
2,6-Dimethyl-5-heptenal propyleneglycol acetal (CHEBI:171825) is a dioxolane (CHEBI:39430)
IUPAC Name 
4-methyl-2-(6-methylhept-5-en-2-yl)-1,3-dioxolane
Manual XrefsDatabases
HMDB0032235HMDB
21105882ChemSpider
Registry NumbersSources
CAS:74094-63-6ChemIDplus