Preferred Name |
montelukast |
|
Synonyms |
CC(C)(O)c1ccccc1CC[C@@H](SCC1(CC1)CC(O)=O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 montelukast (R-(E))-1-(((1-(3-(2-(7-Chloro-2-quinolinyl)ethenyl)phenyl)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propyl)thio)methyl)cyclopropaneacetic acid C35H36ClNO3S InChIKey=UCHDWCPVSPXUMX-TZIWLTJVSA-N 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 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 MONTELUKAST {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 Montelukast |
|
Definitions |
An alkyl sulfide that has formula C35H36ClNO3S. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_50730 |
|
database_cross_reference |
PDBeChem:MTK DrugBank:DB00471 KEGG COMPOUND:158966-92-8 Beilstein:7896575 Patent:EP1886997 KEGG COMPOUND:C07482 Wikipedia:Montelukast ChemIDplus:158966-92-8 |
|
definition |
An alkyl sulfide that has formula C35H36ClNO3S. |
|
has_alternative_id |
CHEBI:49756 CHEBI:6992 |
|
has_exact_synonym |
MONTELUKAST {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 Montelukast |
|
has_related_synonym |
CC(C)(O)c1ccccc1CC[C@@H](SCC1(CC1)CC(O)=O)c1cccc(\C=C\c2ccc3ccc(Cl)cc3n2)c1 montelukast (R-(E))-1-(((1-(3-(2-(7-Chloro-2-quinolinyl)ethenyl)phenyl)-3-(2-(1-hydroxy-1-methylethyl)phenyl)propyl)thio)methyl)cyclopropaneacetic acid C35H36ClNO3S InChIKey=UCHDWCPVSPXUMX-TZIWLTJVSA-N 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 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 |
|
has_RxCUI |
88249 |
|
id |
CHEBI:50730 |
|
imported from | ||
label |
montelukast |
|
notation |
CHEBI:50730 |
|
prefLabel |
montelukast |
|
subClassOf |
http://purl.obolibrary.org/obo/CHEBI_22327 |