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Definition	An primary alcohol that is butan-1-ol in which a hydrogen at position 3 has been replaced by a methyl group.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

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.

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

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