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CHEBI:44009 - 6-methylheptan-1-ol

ChEBI IDCHEBI:44009
ChEBI Name6-methylheptan-1-ol
Stars
DefinitionA primary alcohol that is heptane which is substituted by a methyl group at position 6 and a hydroxy group at position 1.
Last Modified7 February 2019
DownloadsMolfile
FormulaC8H18O
Net Charge0
Average Mass130.231
Monoisotopic Mass130.13577
SMILESCC(C)CCCCCO
InChIInChI=1S/C8H18O/c1-8(2)6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
InChIKeyBWDBEAQIHAEVLV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Millardia meltada (ncbitaxon:121583) - PubMed (29856754) Identified in the crude extract of preputial gland
Roles Classification
Biological Role:
mammalian metabolite  Any animal metabolite produced during a metabolic reaction in mammals.
ChEBI Ontology
Outgoing Relation(s)
6-methylheptan-1-ol (CHEBI:44009) has role mammalian metabolite (CHEBI:75768)
6-methylheptan-1-ol (CHEBI:44009) is a primary alcohol (CHEBI:15734)
6-methylheptan-1-ol (CHEBI:44009) is a volatile organic compound (CHEBI:134179)
Incoming Relation(s)
isooctyl laurate (CHEBI:143015) has functional parent 6-methylheptan-1-ol (CHEBI:44009)
IUPAC Name 
6-methylheptan-1-ol
Synonyms  Source
6-methylheptanolNIST Chemistry WebBook
6-methyl-1-heptanolNIST Chemistry WebBook
Manual XrefsDatabases
MHNPDBeChem
Registry NumbersSources
CAS:1653-40-3ChemIDplus
CAS:1653-40-3NIST Chemistry WebBook
Citations