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CHEBI:60799 - esketamine
| Formula | C13H16ClNO |
| Net Charge | 0 |
| Average Mass | 237.730 |
| Monoisotopic Mass | 237.09204 |
| SMILES | CN[C@]1(c2ccccc2Cl)CCCCC1=O |
| InChI | InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3/t13-/m0/s1 |
| InChIKey | YQEZLKZALYSWHR-ZDUSSCGKSA-N |
| Roles Classification |
|---|
| Chemical Roles: | environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects. Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Roles: | analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. NMDA receptor antagonist Any substance that inhibits the action of N-methyl-D-aspartate (NMDA) receptors. They tend to induce a state known as dissociative anesthesia, marked by catalepsy, amnesia, and analgesia, while side effects can include hallucinations, nightmares, and confusion. Due to their psychotomimetic effects, many NMDA receptor antagonists are used as recreational drugs. analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. 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. NMDA receptor antagonist Any substance that inhibits the action of N-methyl-D-aspartate (NMDA) receptors. They tend to induce a state known as dissociative anesthesia, marked by catalepsy, amnesia, and analgesia, while side effects can include hallucinations, nightmares, and confusion. Due to their psychotomimetic effects, many NMDA receptor antagonists are used as recreational drugs. neurotoxin A poison that interferes with the functions of the nervous system. |
| Applications: | analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. analgesic An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| esketamine (CHEBI:60799) has role analgesic (CHEBI:35480) |
| esketamine (CHEBI:60799) has role intravenous anaesthetic (CHEBI:38877) |
| esketamine (CHEBI:60799) has role NMDA receptor antagonist (CHEBI:60643) |
| esketamine (CHEBI:60799) is a ketamine (CHEBI:6121) |
| esketamine (CHEBI:60799) is enantiomer of (R)-ketamine (CHEBI:580604) |
| Incoming Relation(s) |
| esketamine hydrochloride (CHEBI:60800) has part esketamine (CHEBI:60799) |
| (R)-ketamine (CHEBI:580604) is enantiomer of esketamine (CHEBI:60799) |
| IUPAC Name |
|---|
| (2S)-2-(2-chlorophenyl)-2-(methylamino)cyclohexanone |
| INN | Source |
|---|---|
| esketamine | ChemIDplus |
| Synonyms | Source |
|---|---|
| (S)-2-(o-chlorophenyl)-2-(methylamino)cyclohexanone | ChemIDplus |
| (S)-ketamine | ChemIDplus |
| (S)-(−)-ketamine | ChemIDplus |
| (−)-ketamine | ChemIDplus |
| Registry Numbers | Sources |
|---|---|
| Reaxys:4295313 | Reaxys |
| CAS:33643-46-8 | KEGG DRUG |
| CAS:33643-46-8 | ChemIDplus |