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Tipelukast-[d6]

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General Information
Catalog: BLP-012622
Molecular Formula: C29H32D6O7S
Molecular Weight: 536.71

Chemical Structure

Description	Tipelukast-[d6] is the labelled analogue of Tipelukast, which could be used as an oral anti-inflammatory agent and has been found to exhibit potential activities against non-alcoholic fatty liver disease as a leukotriene receptor antagonist.
Synonyms	Tipelukast-D6
IUPAC Name	4-[6-acetyl-3-[3-(4-acetyl-3-hydroxy-2-propylphenyl)sulfanyl-1,1,2,2,3,3-hexadeuteriopropoxy]-2-propylphenoxy]butanoic acid
Related CAS	125961-82-2 (unlabelled)
Canonical SMILES	CCCC1=C(C=CC(=C1OCCCC(=O)O)C(=O)C)OCCCSC2=C(C(=C(C=C2)C(=O)C)O)CCC
InChI	InChI=1S/C29H38O7S/c1-5-9-23-25(14-12-22(20(4)31)29(23)36-16-7-11-27(32)33)35-17-8-18-37-26-15-13-21(19(3)30)28(34)24(26)10-6-2/h12-15,34H,5-11,16-18H2,1-4H3,(H,32,33)/i8D2,17D2,18D2
InChI Key	KPWYNAGOBXLMSE-YUZNWSDISA-N