CHEBI:83531 - moclobemide

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ChEBI Name moclobemide
ChEBI ID CHEBI:83531
Definition A member of the class of benzamides that is benzamide substituted by a chloro group at position 4 and a 2-(morpholin-4-yl)ethyl group at the nitrogen atom. It acts as a reversible monoamine oxidase inhibitor and is used in the treatment of depression.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H17ClN2O2
Net Charge 0
Average Mass 268.73900
Monoisotopic Mass 268.098
InChI InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)
InChIKey YHXISWVBGDMDLQ-UHFFFAOYSA-N
SMILES Clc1ccc(cc1)C(=O)NCCN1CCOCC1
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): 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.
Application(s): antidepressant
Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
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ChEBI Ontology
Outgoing moclobemide (CHEBI:83531) has role antidepressant (CHEBI:35469)
moclobemide (CHEBI:83531) has role environmental contaminant (CHEBI:78298)
moclobemide (CHEBI:83531) has role xenobiotic (CHEBI:35703)
moclobemide (CHEBI:83531) is a benzamides (CHEBI:22702)
moclobemide (CHEBI:83531) is a monochlorobenzenes (CHEBI:83403)
moclobemide (CHEBI:83531) is a morpholines (CHEBI:38785)
IUPAC Name
4-chloro-N-[2-(morpholin-4-yl)ethyl]benzamide
INNs Sources
moclobemida ChemIDplus
moclobemide ChemIDplus
moclobemidum ChemIDplus
Manual Xrefs Databases
1825 DrugCentral
D02561 KEGG DRUG
DB01171 DrugBank
HMDB0015302 HMDB
LSM-5247 LINCS
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Registry Numbers Types Sources
530974 Reaxys Registry Number Reaxys
71320-77-9 CAS Registry Number NIST Chemistry WebBook
71320-77-9 CAS Registry Number ChemIDplus
71320-77-9 CAS Registry Number KEGG DRUG
Citations Waiting for Citations Types Sources
23616181 PubMed citation Europe PMC
24859491 PubMed citation Europe PMC
24863864 PubMed citation Europe PMC
25335956 PubMed citation Europe PMC
Last Modified
22 February 2017