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Substance Name: L 687908
RN: 132565-33-4
InChIKey: XETIIHXJGVJJAT-NODMNJIGSA-N

Note

  • Potent hydroxyethylene-containing HIV protease inhibitor.

Molecular Weight

  • 681.873
 
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Names and Synonyms

Name of Substance

  • L 687908

Synonym

  • L-687,908

Systematic Name

  • Carbamic acid, (4-(((1-(((1H-benzimidazol-2-ylmethyl)amino)carbonyl)-2-methylbutyl)amino)carbonyl)-2-hydroxy-7-phenyl-1-(phenylmethyl)-6-heptenyl)-, 1,1-dimethylethyl ester, (1S-(1R*,2R*,4S*(1R*,2R*),6E))-

Registry Numbers

CAS Registry Number

  • 132565-33-4

System Generated Number

  • 0132565334

Structure Descriptors

InChI

1S/C40H51N5O5/c1-6-27(2)36(38(48)41-26-35-42-31-22-13-14-23-32(31)43-35)45-37(47)30(21-15-20-28-16-9-7-10-17-28)25-34(46)33(24-29-18-11-8-12-19-29)44-39(49)50-40(3,4)5/h7-20,22-23,27,30,33-34,36,46H,6,21,24-26H2,1-5H3,(H,41,48)(H,42,43)(H,44,49)(H,45,47)/b20-15+/t27?,30-,33+,34+,36?/m1/s1

InChIKey

XETIIHXJGVJJAT-NODMNJIGSA-N

Smiles

C(N[C@H]([C@H](C[C@@H](C\C=C\c1ccccc1)C(=O)N[C@@H]([C@@H](CC)C)C(=O)NCc1nc2c([nH]1)cccc2)O)Cc1ccccc1)(=O)OC(C)(C)C