Cell Culture Ontology

Last uploaded: July 23, 2014
Preferred Name

Synonyms

Ketamine

2-(2-chlorophenyl)-2-(methylamino)cyclohexanone

KETAMINE

ketamine

ketamina

(+-)-ketamine

2-(methylamino)-2-(2-chlorophenyl)cyclohexanone

NMDA

2-(o-chlorophenyl)-2-(methylamino)-cyclohexanone

special K

ketaminum

2-(2-Chloro-phenyl)-2-methylamino-cyclohexanone

dl-ketamine

DL-ketamine

Definitions

A member of the class of cyclohexanones in which one of the hydrogens at position 2 is substituted by a 2-chlorophenyl group, while the other is substituted by a methylamino group.

ID

http://purl.obolibrary.org/obo/CHEBI_6121

charge

0

database_cross_reference

Drug_Central:1523

CAS:100477-72-3

HMDB:HMDB0015352

DrugBank:DB01221

Wikipedia:Ketamine

Patent:BE634208

CAS:6740-88-1

Patent:US3254124

VSDB:2978

Reaxys:2216965

KEGG:D08098

KEGG:C07525

PMID:3783598

definition

A member of the class of cyclohexanones in which one of the hydrogens at position 2 is substituted by a 2-chlorophenyl group, while the other is substituted by a methylamino group.

formula

C13H16ClNO

has_alternative_id

CHEBI:138833

has_exact_synonym

Ketamine

2-(2-chlorophenyl)-2-(methylamino)cyclohexanone

KETAMINE

has_obo_namespace

chebi_ontology

has_related_synonym

ketamine

ketamina

(+-)-ketamine

2-(methylamino)-2-(2-chlorophenyl)cyclohexanone

NMDA

2-(o-chlorophenyl)-2-(methylamino)-cyclohexanone

special K

ketaminum

2-(2-Chloro-phenyl)-2-methylamino-cyclohexanone

dl-ketamine

DL-ketamine

id

CHEBI:6121

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

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

inchikey

YQEZLKZALYSWHR-UHFFFAOYSA-N

label

ketamine

mass

237.72500

monoisotopicmass

237.09204

notation

CHEBI:6121

smiles

CNC1(CCCCC1=O)c1ccccc1Cl

subClassOf

http://purl.obolibrary.org/obo/CHEBI_24431

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