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CHEBI:51041 - acamprosate
| Formula | C5H11NO4S |
| Net Charge | 0 |
| Average Mass | 181.213 |
| Monoisotopic Mass | 181.04088 |
| SMILES | CC(=O)NCCCS(=O)(=O)O |
| InChI | InChI=1S/C5H11NO4S/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H,8,9,10) |
| InChIKey | AFCGFAGUEYAMAO-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Roles Classification |
|---|
| Chemical Role: | environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects. |
| Biological Roles: | neurotransmitter agent A substance used for its pharmacological action on any aspect of neurotransmitter systems. Neurotransmitter agents include agonists, antagonists, degradation inhibitors, uptake inhibitors, depleters, precursors, and modulators of receptor function. xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. |
| Application: | neurotransmitter agent A substance used for its pharmacological action on any aspect of neurotransmitter systems. Neurotransmitter agents include agonists, antagonists, degradation inhibitors, uptake inhibitors, depleters, precursors, and modulators of receptor function. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| acamprosate (CHEBI:51041) has role environmental contaminant (CHEBI:78298) |
| acamprosate (CHEBI:51041) has role neurotransmitter agent (CHEBI:35942) |
| acamprosate (CHEBI:51041) has role xenobiotic (CHEBI:35703) |
| acamprosate (CHEBI:51041) is a acetamides (CHEBI:22160) |
| acamprosate (CHEBI:51041) is a organosulfonic acid (CHEBI:33551) |
| IUPAC Name |
|---|
| 3-acetamidopropane-1-sulfonic acid |
| INNs | Source |
|---|---|
| acamprosate | ChEBI |
| acamprosato | ChEBI |
| acamprosatum | ChEBI |
| Synonyms | Source |
|---|---|
| N-Acetylhomotaurine | ChemIDplus |
| 3-Acetamido-1-propanesulfonic acid | DrugBank |
| Manual Xrefs | Databases |
|---|---|
| D07058 | KEGG DRUG |
| DB00659 | DrugBank |
| Acamprosate | Wikipedia |
| 38 | DrugCentral |
| Registry Numbers | Sources |
|---|---|
| Reaxys:9618349 | Reaxys |
| CAS:77337-76-9 | ChemIDplus |