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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H42N2O9
Molecular Weight 646.7281
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BAZEDOXIFENE-4'-GLUCURONIDE

SMILES

Cc1c2cc(ccc2n(Cc3ccc(cc3)OCCN4CCCCCC4)c1-c5ccc(cc5)O[C@@]6([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C(=O)O)O6)O)O)O)O

InChI

InChIKey=FQGWKISUWBXXJZ-VNOFEJHXSA-N
InChI=1S/C36H42N2O9/c1-22-28-20-25(39)10-15-29(28)38(21-23-6-11-26(12-7-23)45-19-18-37-16-4-2-3-5-17-37)30(22)24-8-13-27(14-9-24)46-36-33(42)31(40)32(41)34(47-36)35(43)44/h6-15,20,31-34,36,39-42H,2-5,16-19,21H2,1H3,(H,43,44)/t31-,32-,33+,34-,36+/m0/s1

HIDE SMILES / InChI

Molecular Formula C36H42N2O9
Molecular Weight 646.7281
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 13:17:46 UTC 2021
Edited
by admin
on Sat Jun 26 13:17:46 UTC 2021
Record UNII
Z7UK9P79LJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BAZEDOXIFENE-4'-GLUCURONIDE
Common Name English
WAY-144883
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-(1-((4-(2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHOXY)PHENYL)METHYL)-5-HYDROXY-3-METHYL-1H-INDOL-2-YL)PHENYL
Systematic Name English
BZA-4'-GLUCURONIDE
Common Name English
4-(1-((4-(2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHOXY)PHENYL)METHYL)-5-HYDROXY-3-METHYL-1H-INDOL-2-YL)PHENYL .BETA.-D-GLUCOPYRANOSIDURONIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
Z7UK9P79LJ
Created by admin on Sat Jun 26 13:17:46 UTC 2021 , Edited by admin on Sat Jun 26 13:17:46 UTC 2021
PRIMARY
CAS
328933-64-8
Created by admin on Sat Jun 26 13:17:46 UTC 2021 , Edited by admin on Sat Jun 26 13:17:46 UTC 2021
PRIMARY
PUBCHEM
71313640
Created by admin on Sat Jun 26 13:17:46 UTC 2021 , Edited by admin on Sat Jun 26 13:17:46 UTC 2021
PRIMARY
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