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Substance Name: LGD-6972 sodium
RN: 1207989-22-7
UNII: C704VNP688
InChIKey: UXVQTOIZZKLZCS-DRRLCDGFSA-M

Molecular Formula

  • C43-H45-N2-O5-S.Na

Molecular Weight

  • 724.8826
 
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Names and Synonyms

Name of Substance

  • LGD-6972 sodium

Synonyms

  • Ethanesulfonic acid, 2-((4-((2R)-2-(4'-(1,1-dimethylethyl)(1,1'-biphenyl)-4-yl)-3-oxo-3-((2',4',6'-trimethyl(1,1'-biphenyl)-4-yl)amino)propyl)benzoyl)amino)-, sodium salt (1:1)
  • LGD-6972 sodium
  • UNII-C704VNP688

Registry Numbers

CAS Registry Number

  • 1207989-22-7

FDA UNII

  • C704VNP688

System Generated Number

  • 1207989227

Structure Descriptors

InChI

1S/C43H46N2O5S.Na/c1-28-25-29(2)40(30(3)26-28)35-17-21-38(22-18-35)45-42(47)39(27-31-7-9-36(10-8-31)41(46)44-23-24-51(48,49)50)34-13-11-32(12-14-34)33-15-19-37(20-16-33)43(4,5)6;/h7-22,25-26,39H,23-24,27H2,1-6H3,(H,44,46)(H,45,47)(H,48,49,50);/q;+1/p-1/t39-;/m1./s1

InChIKey

UXVQTOIZZKLZCS-DRRLCDGFSA-M

Smiles

[Na+].Cc1cc(C)c(c(C)c1)c2ccc(NC(=O)[C@H](Cc3ccc(cc3)C(=O)NCCS(=O)(=O)[O-])c4ccc(cc4)c5ccc(cc5)C(C)(C)C)cc2