Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Grazoprevir sodium
RN: 1425038-27-2
InChIKey: HWKZBIVJZNPHGU-CIAYNJNFSA-M

Molecular Formula

  • C38-H49-N6-O9-S.Na

Molecular Weight

  • 788.8941
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Grazoprevir sodium

Synonyms

  • Grazoprevir sodium
  • MK 5172 sodium
  • MK 5172 sodium salt

Registry Numbers

CAS Registry Number

  • 1425038-27-2

System Generated Number

  • 1425038272

Structure Descriptors

InChI

1S/C38H50N6O9S.Na/c1-6-22-19-38(22,35(47)43-54(49,50)25-13-14-25)42-32(45)29-18-24-20-44(29)34(46)31(37(2,3)4)41-36(48)53-30-16-21(30)10-8-7-9-11-27-33(52-24)40-28-17-23(51-5)12-15-26(28)39-27;/h6,12,15,17,21-22,24-25,29-31H,1,7-11,13-14,16,18-20H2,2-5H3,(H3,41,42,43,45,47,48);/q;+1/p-1/t21-,22-,24-,29+,30-,31-,38-;/m1./s1

InChIKey

HWKZBIVJZNPHGU-CIAYNJNFSA-M

Smiles

[Na+].COc1ccc2nc3CCCCC[C@@H]4C[C@H]4OC(=O)N[C@H](C(=O)N5C[C@@H](C[C@H]5C(=O)N[C@@]6(C[C@H]6C=C)C(=O)[N-]S(=O)(=O)C7CC7)Oc3nc2c1)C(C)(C)C