Montelukast acid, rac-

Details

Stereochemistry	RACEMIC
Molecular Formula	C35H36ClNO3S
Molecular Weight	586.183
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(O)C1=CC=CC=C1CCC(SCC2(CC(O)=O)CC2)C3=CC=CC(\C=C\C4=NC5=CC(Cl)=CC=C5C=C4)=C3

InChI

InChIKey=UCHDWCPVSPXUMX-XNTDXEJSSA-N

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+

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Montelukast acid, rac-

Common Name

English

Cyclopropaneacetic acid, 1-[[[1-[3-[(1E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]-

Common Name

English

2-(1-{[(1-{3-[2-(7-chloroquinolin-2-yl)ethenyl]phenyl}-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl)sulfanyl]methyl}cyclopropyl)acetic acid

Systematic Name

English

1-[[[1-[3-[(1E)-2-(7-Chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]cyclopropaneacetic acid

Common Name

English

rac-Montelukast acid

Common Name

English

Code System Code Type Description

PUBCHEM

5284590

Created by admin on Sat Dec 16 19:31:15 GMT 2023 , Edited by admin on Sat Dec 16 19:31:15 GMT 2023

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CAS

220927-26-4

Created by admin on Sat Dec 16 19:31:14 GMT 2023 , Edited by admin on Sat Dec 16 19:31:14 GMT 2023

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FDA UNII

FCN5GTP4RC

Created by admin on Sat Dec 16 19:31:15 GMT 2023 , Edited by admin on Sat Dec 16 19:31:15 GMT 2023

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SUBSTANCE RECORD


					FCN5GTP4RC

Montelukast acid, rac-