CHEBI:50140 - methadone hydrochloride

ChEBI IDCHEBI:50140
ChEBI Namemethadone hydrochloride
Stars
Last Modified17 June 2008
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC21H27NO.HCl
Net Charge0
Average Mass345.914
Monoisotopic Mass345.18594
SMILESCCC(=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C21H27NO.ClH/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19;/h6-15,17H,5,16H2,1-4H3;1H
InChIKeyFJQXCDYVZAHXNS-UHFFFAOYSA-N
Roles Classification
Biological Roles:
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
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.
Application:
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)
methadone hydrochloride (CHEBI:50140) has part methadone (CHEBI:6807)
methadone hydrochloride (CHEBI:50140) has role analgesic (CHEBI:35480)
methadone hydrochloride (CHEBI:50140) has role anti-HIV agent (CHEBI:64946)
methadone hydrochloride (CHEBI:50140) is a hydrochloride (CHEBI:36807)
IUPAC Name 
6-(dimethylamino)-4,4-diphenylheptan-3-one hydrochloride
Synonyms  Source
AlgolysinChemIDplus
AN-148ChEMBL
ButalginChEMBL
DL-Methadone hydrochlorideDrugBank
Dolofin hydrochlorideChEMBL
DolophineChEMBL
Brand Names  Source
Adanon hydrochlorideChEMBL
AdolanDrugBank
Dolophine hydrochlorideKEGG DRUG
EptadoneChEMBL
HeptadonDrugBank
MartindaleChEMBL
Manual XrefsDatabases
D02102KEGG DRUG
Registry NumbersSources
Beilstein:3919789Beilstein
CAS:1095-90-5KEGG DRUG
CAS:1095-90-5ChemIDplus
Citations