3-methyl-2-pentanol (CHEBI:77520)

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ChEBI Name	3-methyl-2-pentanol

ChEBI ID	CHEBI:77520

Definition	A secondary alcohol that is 3-methylpentane substituted at position 2 by a hydroxy group.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Jen Hammock

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Formula

C6H14O

Net Charge

Average Mass

102.17480

Monoisotopic Mass

102.10447

InChI

InChI=1S/C6H14O/c1-4-5(2)6(3)7/h5-7H,4H2,1-3H3

InChIKey

ZXNBBWHRUSXUFZ-UHFFFAOYSA-N

SMILES

CCC(C)C(C)O

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans.

Application(s):	biomarker A substance used as an indicator of a biological state.

ChEBI Ontology
Outgoing	3-methyl-2-pentanol (CHEBI:77520) has role biomarker (CHEBI:59163) 3-methyl-2-pentanol (CHEBI:77520) has role human xenobiotic metabolite (CHEBI:76967) 3-methyl-2-pentanol (CHEBI:77520) has role plant metabolite (CHEBI:76924) 3-methyl-2-pentanol (CHEBI:77520) is a secondary alcohol (CHEBI:35681)

IUPAC Name

3-methylpentan-2-ol

Last Modified

12 March 2014