isoamylol (CHEBI:15837)

CHEBI:15837 - isoamylol

ChEBI ID	CHEBI:15837
ChEBI Name	isoamylol
Stars
Definition	An primary alcohol that is butan-1-ol in which a hydrogen at position 3 has been replaced by a methyl group.
Secondary ChEBI IDs	CHEBI:1597, CHEBI:11855, CHEBI:20125, CHEBI:43359
Last Modified	7 August 2025
Downloads	Molfile

Formula	C5H12O
Net Charge	0
Average Mass	88.150
Monoisotopic Mass	88.08882
SMILES	CC(C)CCO
InChI	InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3
InChIKey	PHTQWCKDNZKARW-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)
	saliva (UBERON:0001836)	PubMed (24421258)
	faeces (UBERON:0001988)	PubMed (20055983)
Saccharomyces cerevisiae (ncbitaxon:4932)	-	PubMed (24678285)	Source: yeast.sf.net
Starmerella bacillaris (ncbitaxon:1247836)	-	MetaboLights (MTBLS212)	From MetaboLights
Vitis vinifera (ncbitaxon:29760)	-	MetaboLights (MTBLS212)	From MetaboLights
Parastagonospora nodorum (ncbitaxon:13684)	-	PubMed (23043843)

Roles Classification

Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).

antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.

xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound.

ChEBI Ontology

Outgoing Relation(s)
	isoamylol (CHEBI:15837) has parent hydride isopentane (CHEBI:30362)
	isoamylol (CHEBI:15837) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
	isoamylol (CHEBI:15837) has role antifungal agent (CHEBI:35718)
	isoamylol (CHEBI:15837) has role xenobiotic metabolite (CHEBI:76206)
	isoamylol (CHEBI:15837) is a alkyl alcohol (CHEBI:50584)
	isoamylol (CHEBI:15837) is a primary alcohol (CHEBI:15734)
	isoamylol (CHEBI:15837) is a volatile organic compound (CHEBI:134179)
Incoming Relation(s)
	3-methylbutyl 2-hydroxypropanoate (CHEBI:87534) has functional parent isoamylol (CHEBI:15837)
	3-methylbutyl dodecanoate (CHEBI:87343) has functional parent isoamylol (CHEBI:15837)
	3-methylbutyl hexadecanoate (CHEBI:235326) has functional parent isoamylol (CHEBI:15837)
	3-methylbutyl hexanoate (CHEBI:87542) has functional parent isoamylol (CHEBI:15837)
	3-methylbutyl octanoate (CHEBI:87536) has functional parent isoamylol (CHEBI:15837)
	isoamyl acetate (CHEBI:31725) has functional parent isoamylol (CHEBI:15837)
	isoamyl butyrate (CHEBI:87422) has functional parent isoamylol (CHEBI:15837)
	isoamyl formate (CHEBI:31726) has functional parent isoamylol (CHEBI:15837)
	isoamyl isobutyrate (CHEBI:87537) has functional parent isoamylol (CHEBI:15837)
	isoamyl nitrite (CHEBI:2691) has functional parent isoamylol (CHEBI:15837)
	isoamyl propanoate (CHEBI:87419) has functional parent isoamylol (CHEBI:15837)

IUPAC Name
3-methylbutan-1-ol

UniProt Name	Source
3-methylbutan-1-ol	UniProt

Citations