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> Main
CHEBI:50140 - methadone hydrochloride
Main
ChEBI Ontology
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ChEBI Name
methadone hydrochloride
ChEBI ID
CHEBI:50140
Stars
This entity has been manually annotated by the ChEBI Team.
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Formulae
C21H27NO.HCl
C21H28ClNO
Net Charge
0
Average Mass
345.90586
Monoisotopic Mass
345.18594
InChI
InChI=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
InChIKey
FJQXCDYVZAHXNS-UHFFFAOYSA-N
SMILES
Cl.CCC(=O)C(CC(C)N(C)C)(c1ccccc1)c1ccccc1
ChEBI Ontology
Outgoing
methadone hydrochloride (
CHEBI:50140
)
has part
methadone (
CHEBI:6807
)
methadone hydrochloride (
CHEBI:50140
)
is a
hydrochloride (
CHEBI:36807
)
IUPAC Name
6-(dimethylamino)-4,4-diphenylheptan-3-one hydrochloride
Synonyms
Sources
(±)-methadone hydrochloride
DrugBank
Algolysin
ChemIDplus
DL-Methadone hydrochloride
DrugBank
Phenadone hydrochloride
DrugBank
Brand Names
Sources
Adolan
DrugBank
Dolophine hydrochloride
KEGG DRUG
Heptadon
DrugBank
Physeptone
DrugBank
Manual Xref
Database
D02102
KEGG DRUG
View more database links
Registry Numbers
Types
Sources
1095-90-5
CAS Registry Number
ChemIDplus
1095-90-5
CAS Registry Number
KEGG DRUG
3919789
Beilstein Registry Number
Beilstein
Last Modified
17 June 2008