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CHEBI:17578 - toluene
| Formula | C7H8 |
| Net Charge | 0 |
| Average Mass | 92.141 |
| Monoisotopic Mass | 92.06260 |
| SMILES | Cc1ccccc1 |
| InChI | InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | YXFVVABEGXRONW-UHFFFAOYSA-N |
| Wikipedia |
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| Roles Classification |
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| Chemical Roles: | fuel additive Any additive that enhances the efficiency of fuel. |
| Biological Roles: | cholinergic antagonist Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists. neurotoxin A poison that interferes with the functions of the nervous system. |
| Applications: | cholinergic antagonist Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| toluene (CHEBI:17578) has role cholinergic antagonist (CHEBI:48873) |
| toluene (CHEBI:17578) has role fuel additive (CHEBI:62803) |
| toluene (CHEBI:17578) has role neurotoxin (CHEBI:50910) |
| toluene (CHEBI:17578) has role non-polar solvent (CHEBI:48355) |
| toluene (CHEBI:17578) is a methylbenzene (CHEBI:38975) |
| toluene (CHEBI:17578) is a toluenes (CHEBI:27024) |
| toluene (CHEBI:17578) is a volatile organic compound (CHEBI:134179) |
| Incoming Relation(s) |
| 2-methyl-1,4-phenylenediamine (CHEBI:53619) has parent hydride toluene (CHEBI:17578) |
| 2,6-diaminotoluene (CHEBI:76288) has parent hydride toluene (CHEBI:17578) |
| benzyl thiol (CHEBI:137674) has parent hydride toluene (CHEBI:17578) |
| thiobenzaldehyde (CHEBI:137675) has parent hydride toluene (CHEBI:17578) |
| benzyl group (CHEBI:22744) is substituent group from toluene (CHEBI:17578) |
| IUPAC Name |
|---|
| toluene |
| Synonyms | Source |
|---|---|
| methylbenzene | PDBeChem |
| phenylmethane | ChemIDplus |
| Toluen | NIST Chemistry WebBook |
| Toluene | KEGG COMPOUND |
| TOLUENE | PDBeChem |
| toluène | ChEBI |
| UniProt Name | Source |
|---|---|
| toluene | UniProt |
| Citations |
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