EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C10H20O |
| Net Charge | 0 |
| Average Mass | 156.269 |
| Monoisotopic Mass | 156.15142 |
| SMILES | CC(C)C1CCC(C)(O)CC1 |
| InChI | InChI=1S/C10H20O/c1-8(2)9-4-6-10(3,11)7-5-9/h8-9,11H,4-7H2,1-3H3 |
| InChIKey | CMLYGGFIXXLYQT-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | faeces (UBERON:0001988) | PubMed (23454028) | |
| Medicago sativa (ncbitaxon:3879) | - | DOI (10.1021/jf00048a054) | |
| Pyrus sinkiangensis (ncbitaxon:363829) | - | PubMed (33260963) | |
| Mentha x smithiana (ncbitaxon:301896) | - | PubMed (33918674) |
| Roles Classification |
|---|
| Biological Roles: | volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| p-menthan-1-ol (CHEBI:89236) has role human metabolite (CHEBI:77746) |
| p-menthan-1-ol (CHEBI:89236) has role volatile oil component (CHEBI:27311) |
| p-menthan-1-ol (CHEBI:89236) is a p-menthane monoterpenoid (CHEBI:25186) |
| p-menthan-1-ol (CHEBI:89236) is a tertiary alcohol (CHEBI:26878) |
| p-menthan-1-ol (CHEBI:89236) is a volatile organic compound (CHEBI:134179) |
| IUPAC Name |
|---|
| 1-methyl-4-(propan-2-yl)cyclohexanol |
| Synonyms | Source |
|---|---|
| 1-methyl-4-(propan-2-yl)cyclohexan-1-ol | IUPAC |
| 4-isopropyl-1-methylcyclohexanol | HMDB |
| 1-methyl-4-(1-methylethyl)-cyclohexanol | HMDB |
| 1-methyl-4-(1-methylethyl)cyclohexanol | ChemIDplus |
| 1-methyl-4-(isopropyl)cyclohexan-1-ol | ChemIDplus |
| Manual Xrefs | Databases |
|---|---|
| HMDB0037020 | HMDB |
| FDB016000 | FooDB |
| 80716 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:21129-27-1 | ChemIDplus |
| CAS:21129-27-1 | NIST Chemistry WebBook |
| Citations |
|---|