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Substance Name: Hydroxyritonavir
RN: 176655-56-4
UNII: JN1D7K606N
InChIKey: CLEDZMPJHBBTNZ-QJANCWQKSA-N

Molecular Formula

  • C37-H48-N6-O6-S2

Molecular Weight

  • 736.9542
 
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Names and Synonyms

Name of Substance

  • Hydroxyritonavir

Synonyms

  • 2,7,10,12-Tetraazatridecanoic acid, 4-hydroxy-13-(2-(1-hydroxy-1-methylethyl)-4-thiazolyl)-12-methyl-9-(1-methylethyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3S,4S,6S,9S)-
  • Hydroxy ritonavir
  • Hydroxyritonavir
  • Ritonavir impurity, hydroxyritonavir- [USP]
  • Ritonavir specified impurity E [EP]
  • Thiazol-5-ylmethyl ((1S,2S,4S)-1-benzyl-2-hydroxy-4-(((2S)-2-((((2-(1-hydroxy-1-methylethyl)thiazol-4-yl)methyl)methylcarbamoyl)amino)-3-methylbutanoyl)amino)-5-phenylpentyl)carbamate
  • UNII-JN1D7K606N

Registry Numbers

CAS Registry Number

  • 176655-56-4

FDA UNII

  • JN1D7K606N

System Generated Number

  • 0176655564

Structure Descriptors

InChI

1S/C37H48N6O6S2/c1-24(2)32(42-35(46)43(5)20-28-22-50-34(40-28)37(3,4)48)33(45)39-27(16-25-12-8-6-9-13-25)18-31(44)30(17-26-14-10-7-11-15-26)41-36(47)49-21-29-19-38-23-51-29/h6-15,19,22-24,27,30-32,44,48H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/t27-,30-,31-,32-/m0/s1

InChIKey

CLEDZMPJHBBTNZ-QJANCWQKSA-N

Smiles

CC(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C[C@@H]([C@H](Cc2ccccc2)NC(=O)OCc3cncs3)O)NC(=O)N(C)Cc4csc(n4)C(C)(C)O