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Substance Name: Lopinavir impurity, lopinavir o-phenoxyactyl- [USP]
RN: 943250-65-5
UNII: 33726A24AB
InChIKey: GLRUDDIFBLTZDO-PUTFYWIISA-N

Molecular Formula

  • C47-H58-N4-O7

Molecular Weight

  • 790.9962
 
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Names and Synonyms

Results Name

  • Lopinavir impurity, lopinavir o-phenoxyactyl- [USP]

Name of Substance

  • 2-(2-(2,6-Dimethylphenoxy)acetamido)-5-((S)-3-methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanamido(-1,6-diphenylhexan-3-yl 2-(2,6-dimethylphenoxy)acetate, (2S,3S,5S)-

Synonyms

  • (1S,3S)-1-((1S)-1-((2-(2,6-Dimethylphenoxy)acetyl)amino)-2-phenylethyl)-3-(((2S)-3-methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoyl)amino)-4-phenylbutyl 2-(2,6-dimethylphenoxy)acetate
  • (2S,3S,5S)-2-(2-(2,6-Dimethylphenoxy)acetamido)-5-((S)-3-methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanamido(-1,6-diphenylhexan-3-yl 2-(2,6-dimethylphenoxy)acetate
  • 2-(2-(2,6-Dimethylphenoxy)acetamido)-5-((S)-3-methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanamido(-1,6-diphenylhexan-3-yl 2-(2,6-dimethylphenoxy)acetate, (2S,3S,5S)-
  • Acetic acid, 2-(2,6-dimethylphenoxy)-, (1S,3S)-1-((1S)-1-((2-(2,6-dimethylphenoxy)acetyl)amino)-2-phenylethyl)-3-(((2S)-3-methyl-1-oxo-2-(tetrahydro-2-oxo-1(2H)-pyrimidinyl)butyl)amino)-4-phenylbutyl ester
  • Lopinavir impurity S [EP]
  • Lopinavir impurity, lopinavir o-phenoxyactyl- [USP]
  • Lopinavir o-phenoxyactyl
  • UNII-33726A24AB

Registry Numbers

CAS Registry Number

  • 943250-65-5

FDA UNII

  • 33726A24AB

System Generated Number

  • 0943250655

Structure Descriptors

InChI

1S/C47H58N4O7/c1-31(2)43(51-25-15-24-48-47(51)55)46(54)49-38(26-36-20-9-7-10-21-36)28-40(58-42(53)30-57-45-34(5)18-14-19-35(45)6)39(27-37-22-11-8-12-23-37)50-41(52)29-56-44-32(3)16-13-17-33(44)4/h7-14,16-23,31,38-40,43H,15,24-30H2,1-6H3,(H,48,55)(H,49,54)(H,50,52)/t38-,39-,40-,43-/m0/s1

InChIKey

GLRUDDIFBLTZDO-PUTFYWIISA-N

Smiles

Cc1cccc(c1OCC(=O)N[C@@H](Cc2ccccc2)[C@H](C[C@H](Cc3ccccc3)NC(=O)[C@H](C(C)C)N4CCCNC4=O)OC(=O)COc5c(cccc5C)C)C