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montelukast

CHEBI:CHEBI_50730

Chemical Information

Molecular Formula
C35H36ClNO3S
Molecular Mass
586.18398
Charge
0
SMILES
CC(C)(O)c1ccccc1CC[C@@H](SCC1(CC1)CC(O)=O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1
InChI
InChI=1S/C35H36ClNO3S/c1-34(2,40)30-9-4-3-7-25(30)13-17-32(41-23-35(18-19-35)22-33(38)39)27-8-5-6-24(20-27)10-15-29-16-12-26-11-14-28(36)21-31(26)37-29/h3-12,14-16,20-21,32,40H,13,17-19,22-23H2,1-2H3,(H,38,39)/b15-10+/t32-/m1/s1
InChIKey
UCHDWCPVSPXUMX-TZIWLTJVSA-N

Alternative Names

  • (R-(E))-1-(((1-(3-(2-(7-Chloro-2-quinolinyl)ethenyl)phenyl)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propyl)thio)methyl)cyclopropaneacetic acid
  • {1-[({(1R)-1-{3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl}-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl}sulfanyl)methyl]cyclopropyl}acetic acid
  • 1-[[[(1 R)-1-[3-[(1E)-2-(7-chloro-2-quinolinyl)ethenyl] phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]sulfanyl]methyl]cyclopropaneacetic acid
  • montelukast
  • Montelukast
  • MONTELUKAST

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
88249
oboInOwl#hasDbXref
Wikipedia:Montelukast
core#notation
CHEBI:50730

Additional References

Wikipedia:Montelukast

🔍 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
88249
oboInOwl#hasDbXref
Wikipedia:Montelukast
oboInOwl#hasAlternativeId
CHEBI:6992
oboInOwl#id
CHEBI:50730
core#notation
CHEBI:50730
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_49159
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
BFO_0000053
http://purl.obolibrary.org/obo/DRON_00000063
chebi#is_conjugate_acid_of
http://purl.obolibrary.org/obo/CHEBI_49165
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
has_treatment
http://purl.obolibrary.org/obo/DOID_0080816
rdf-schema#domain
https://w3id.org/def/predibionto#has_side_effect26411
chebi#is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_49165
owl#someValuesFrom
t3010484
owl#annotatedSource
t238798