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CHEBI:15837 - isoamylol
| 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) | ||
| Parastagonospora nodorum (ncbitaxon:13684) | - | PubMed (23043843) | |
| 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 |
| Roles Classification |
|---|
| Biological Roles: | xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. 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 |
| Synonyms | Source |
|---|---|
| 1-HYDROXY-3-METHYLBUTANE | PDBeChem |
| 2-methyl-4-butanol | ChemIDplus |
| 3-methyl-1-butanol | NIST Chemistry WebBook |
| 3-Methylbutanol | KEGG COMPOUND |
| alcool isoamylique | ChemIDplus |
| i-amyl alcohol | NIST Chemistry WebBook |
| UniProt Name | Source |
|---|---|
| 3-methylbutan-1-ol | UniProt |
| Citations |
|---|