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CHEBI:650657 - ketamine hydrochloride

ChEBI IDCHEBI:650657
ChEBI Nameketamine hydrochloride
Stars
DefinitionThe hydrochloride salt of ketamine.
Secondary ChEBI IDsCHEBI:6122, CHEBI:138629
Last Modified3 August 2014
DownloadsMolfile
FormulaC13H17ClNO.Cl
Net Charge0
Average Mass274.191
Monoisotopic Mass273.06872
SMILESC[NH2+]C1(c2ccccc2Cl)CCCCC1=O.[Cl-]
InChIInChI=1S/C13H16ClNO.ClH/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;1H
InChIKeyVCMGMSHEPQENPE-UHFFFAOYSA-N
Roles Classification
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.
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.
ChEBI Ontology
Outgoing Relation(s)
ketamine hydrochloride (CHEBI:650657) has part ketamine (CHEBI:6121)
ketamine hydrochloride (CHEBI:650657) has role analgesic (CHEBI:35480)
ketamine hydrochloride (CHEBI:650657) has role intravenous anaesthetic (CHEBI:38877)
ketamine hydrochloride (CHEBI:650657) has role NMDA receptor antagonist (CHEBI:60643)
ketamine hydrochloride (CHEBI:650657) is a hydrochloride (CHEBI:36807)
Incoming Relation(s)
esketamine hydrochloride (CHEBI:60800) is a ketamine hydrochloride (CHEBI:650657)
IUPAC Names 
2-(2-chlorophenyl)-2-(methylamino)cyclohexanone hydrochloride
1-(2-chlorophenyl)-N-methyl-2-oxocyclohexanaminium chloride
Synonyms  Source
CI-581ChEMBL
CL-369ChEMBL
CN-52372-2ChEMBL
KETAMINE HYDROCHLORIDEChEMBL
2-(o-chlorophenyl)-2-(methylamino)cyclohexanone hydrochlorideChEBI
(±)-2-(o-chlorophenyl)-2-(methylamino)cyclohexanone hydrochlorideChemIDplus
Brand Names  Source
KetajectDrugBank
KetalarDrugBank
KetanestDrugBank
Manual XrefsDatabases
D00711KEGG DRUG
DB01221DrugBank
Registry NumbersSources
Reaxys:5318526Reaxys
CAS:1867-66-9ChemIDplus
CAS:1867-66-9KEGG DRUG