Discuss This Drug

bedaquiline

CHEBI:CHEBI_72292

Definition

A quinoline-based antimycobacterial drug used (as its fumarate salt) for the treatment of pulmonary multi-drug resistant tuberculosis by inhibition of ATP synthase, an enzyme essential for the replication of the mycobacteria.

Chemical Information

Molecular Formula
C32H31BrN2O2
Molecular Mass
555.50500
Charge
0
SMILES
COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12
InChI
InChI=1S/C32H31BrN2O2/c1-35(2)19-18-32(36,28-15-9-13-22-10-7-8-14-26(22)28)30(23-11-5-4-6-12-23)27-21-24-20-25(33)16-17-29(24)34-31(27)37-3/h4-17,20-21,30,36H,18-19H2,1-3H3/t30-,32-/m1/s1
InChIKey
QUIJNHUBAXPXFS-XLJNKUFUSA-N

Alternative Names

  • (1R,2S)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenylbutan-2-ol
  • 1-(6-Bromo-2-methoxy-quinolin-3-yl)-4-dimethylamino-2-naphthalen-1-yl-1-phenyl-butan-2-ol
  • bedaquilina
  • bedaquiline
  • bedaquilinum
  • R 207910
  • R207910
  • TMC 207
  • TMC-207
  • TMC207

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
1364504
oboInOwl#hasDbXref
Wikipedia:Bedaquiline
core#notation
CHEBI:72292

Additional References

Wikipedia:Bedaquiline

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
1364504
oboInOwl#hasDbXref
Wikipedia:Bedaquiline
oboInOwl#id
CHEBI:72292
core#notation
CHEBI:72292
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_33231
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
chebi#is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_72706
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
has_treatment
http://purl.obolibrary.org/obo/DOID_401
rdf-schema#domain
https://w3id.org/def/predibionto#has_side_effect33425
chebi#is_conjugate_acid_of
http://purl.obolibrary.org/obo/CHEBI_72706
owl#annotatedSource
t280217
owl#someValuesFrom
t3009670