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Substance Name: BMS-423526
RN: 380468-71-3
UNII: 41B855CV9E
InChIKey: JNDIIWUWMDEZSL-ZOBSUGNGSA-M

Molecular Formula

  • C30-H31-F-N-O4.Na

Molecular Weight

  • 511.5596
 
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Names and Synonyms

Name of Substance

  • BMS-423526

Synonyms

  • 6-Heptenoic acid, 7-(4-(4-fluorophenyl)-6,7-dihydro-2-(1-methylethyl)-5H-benzo(6,7)cyclohepta(1,2-b)pyridin-3-yl)-3,5-dihydroxy-, sodium salt (1:1), (3R,5S,6E)-
  • BMS-423526
  • UNII-41B855CV9E

Registry Numbers

CAS Registry Number

  • 380468-71-3

FDA UNII

  • 41B855CV9E

System Generated Number

  • 0380468713

Structure Descriptors

InChI

1S/C30H32FNO4.Na/c1-18(2)29-26(15-14-22(33)16-23(34)17-27(35)36)28(20-10-12-21(31)13-11-20)25-9-5-7-19-6-3-4-8-24(19)30(25)32-29;/h3-4,6,8,10-15,18,22-23,33-34H,5,7,9,16-17H2,1-2H3,(H,35,36);/q;+1/p-1/b15-14+;/t22-,23-;/m1./s1

InChIKey

JNDIIWUWMDEZSL-ZOBSUGNGSA-M

Smiles

[Na+].CC(C)c1nc2c(CCCc3ccccc23)c(c1\C=C\[C@@H](O)C[C@@H](O)CC(=O)[O-])c4ccc(F)cc4