CHEBI:63910 - 4-methylpentan-1-ol

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ChEBI Name 4-methylpentan-1-ol
ChEBI ID CHEBI:63910
Definition A primary alcohol that is pentan-1-ol bearing an additional methyl substituent at position 4.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H14O
Net Charge 0
Average Mass 102.17480
Monoisotopic Mass 102.104
InChI InChI=1S/C6H14O/c1-6(2)4-3-5-7/h6-7H,3-5H2,1-2H3
InChIKey PCWGTDULNUVNBN-UHFFFAOYSA-N
SMILES CC(C)CCCO
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 4-methylpentan-1-ol (CHEBI:63910) has role metabolite (CHEBI:25212)
4-methylpentan-1-ol (CHEBI:63910) is a alkyl alcohol (CHEBI:50584)
4-methylpentan-1-ol (CHEBI:63910) is a primary alcohol (CHEBI:15734)
IUPAC Name
4-methylpentan-1-ol
Synonyms Sources
2-Methyl-5-pentanol NIST Chemistry WebBook
4-Methyl-1-pentanol ChemIDplus
4-methylpentan-1-ol UniProt
4-Methylpentanol ChemIDplus
iso-Hexanol ChemIDplus
Isohexanol ChemIDplus
Isohexyl alcohol ChemIDplus
Manual Xrefs Databases
4-Methylpentan-1-ol Wikipedia
HMDB0059889 HMDB
US2011177571 Patent
View more database links
Registry Numbers Types Sources
1320-98-5 CAS Registry Number ChemIDplus
1731303 Beilstein Registry Number ChemIDplus
1731303 Reaxys Registry Number Reaxys
626-89-1 CAS Registry Number NIST Chemistry WebBook
626-89-1 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
1616394 PubMed citation Europe PMC
Last Modified
21 November 2018