maralixibat

Modify Date: 2024-01-05 16:39:05

maralixibat Structure
maralixibat structure
Common Name maralixibat
CAS Number 716313-53-0 Molecular Weight 674.955
Density N/A Boiling Point N/A
Molecular Formula C40H56N3O4S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name maralixibat
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C40H56N3O4S
Molecular Weight 674.955
Exact Mass 674.398621
LogP 4.13
InChIKey STPKWKPURVSAJF-LJEWAXOPSA-N
SMILES CCCCC1(CCCC)CS(=O)(=O)c2ccc(N(C)C)cc2C(c2ccc(OCc3ccc(C[N+]45CCN(CC4)CC5)cc3)cc2)C1O

 Synonyms

1-[4-({4-[(4R,5R)-3,3-Dibutyl-7-(dimethylamino)-4-hydroxy-1,1-dioxido-2,3,4,5-tetrahydro-1-benzothiepin-5-yl]phenoxy}methyl)benzyl]-4-aza-1-azoniabicyclo[2.2.2]octane
UNII:UYB6UOF69L
maralixibat
4-Aza-1-azoniabicyclo[2.2.2]octane, 1-[[4-[[4-[(4R,5R)-3,3-dibutyl-7-(dimethylamino)-2,3,4,5-tetrahydro-4-hydroxy-1,1-dioxido-1-benzothiepin-5-yl]phenoxy]methyl]phenyl]methyl]-
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