CHEBI:3219 - bupropion

ChEBI IDCHEBI:3219
ChEBI Namebupropion
Stars
DefinitionAn aromatic ketone that is propiophenone carrying a tert-butylamino group at position 2 and a chloro substituent at position 3 on the phenyl ring.
Last Modified6 February 2018
DownloadsMolfile
FormulaC13H18ClNO
Net Charge0
Average Mass239.746
Monoisotopic Mass239.10769
SMILESCC(NC(C)(C)C)C(=O)c1cccc(Cl)c1
InChIInChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3
InChIKeySNPPWIUOZRMYNY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Roles:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
anti-obesity agent  Any substance which is used to reduce or control weight.
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.
Applications:
anxiolytic drug  Anxiolytic drugs are agents that alleviate anxiety, tension, and anxiety disorders, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions.
hypoglycemic agent  A drug which lowers the blood glucose level.
anti-anaemic agent  A compound which increases either the number of red cells or the amount of haemoglobin in the blood.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
antipsychotic agent  Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
bupropion (CHEBI:3219) has role anti-anaemic agent (CHEBI:75835)
bupropion (CHEBI:3219) has role anti-obesity agent (CHEBI:74518)
bupropion (CHEBI:3219) has role antidepressant (CHEBI:35469)
bupropion (CHEBI:3219) has role antineoplastic agent (CHEBI:35610)
bupropion (CHEBI:3219) has role antipsychotic agent (CHEBI:35476)
bupropion (CHEBI:3219) has role anxiolytic drug (CHEBI:35474)
bupropion (CHEBI:3219) has role environmental contaminant (CHEBI:78298)
bupropion (CHEBI:3219) has role hypoglycemic agent (CHEBI:35526)
bupropion (CHEBI:3219) has role xenobiotic (CHEBI:35703)
bupropion (CHEBI:3219) is a aromatic ketone (CHEBI:76224)
bupropion (CHEBI:3219) is a monochlorobenzenes (CHEBI:83403)
bupropion (CHEBI:3219) is a secondary amino compound (CHEBI:50995)
Incoming Relation(s)
(R)-bupropion (CHEBI:36794) is a bupropion (CHEBI:3219)
(S)-bupropion (CHEBI:36793) is a bupropion (CHEBI:3219)
IUPAC Name 
2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one
INN  Source
bupropioneWHO MedNet
Synonyms  Source
BupropionKEGG COMPOUND
Bupropion extended releaseChEMBL
Bupropion slow releaseChEMBL
NSC-758686ChEMBL
Manual XrefsDatabases
435DrugCentral
BupropionWikipedia
C06860KEGG COMPOUND
CPD-3481MetaCyc
D07591KEGG DRUG
DB01156DrugBank
HMDB0001510HMDB
LSM-1267LINCS
Registry NumbersSources
Reaxys:2101062Reaxys
CAS:34841-39-9KEGG COMPOUND
CAS:34911-55-2ChemIDplus
Citations