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Substance Name: Carbamic acid, (2-hydroxy-5-((2-methyl-1-(((phenylmethyl)amino)carbonyl)butyl)amino)-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester, (1S-(1R*,2R*,4S*,5(1R*,2R*)))-
RN: 126409-47-0
InChIKey: UZBJXXZZZVEMND-HKCXKINDSA-N

Molecular Formula

  • C37-H49-N3-O5

Molecular Weight

  • 615.8101
 
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Names and Synonyms

Synonyms

  • 6-Phenyl-5-(N-t-butyloxycarbonylamino)-4-hydroxy-2-benzyl-1-((N-benzyl)-isoleucylamide)-hexanone
  • Boc-CH2Ph-Ile-NH-Bn

Systematic Name

  • Carbamic acid, (2-hydroxy-5-((2-methyl-1-(((phenylmethyl)amino)carbonyl)butyl)amino)-5-oxo-1,4-bis(phenylmethyl)pentyl)-, 1,1-dimethylethyl ester, (1S-(1R*,2R*,4S*,5(1R*,2R*)))-

Registry Numbers

CAS Registry Number

  • 126409-47-0

System Generated Number

  • 0126409470

Structure Descriptors

InChI

1S/C37H49N3O5/c1-6-26(2)33(35(43)38-25-29-20-14-9-15-21-29)40-34(42)30(22-27-16-10-7-11-17-27)24-32(41)31(23-28-18-12-8-13-19-28)39-36(44)45-37(3,4)5/h7-21,26,30-33,41H,6,22-25H2,1-5H3,(H,38,43)(H,39,44)(H,40,42)/t26-,30+,31-,32-,33-/m0/s1

InChIKey

UZBJXXZZZVEMND-HKCXKINDSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)NCc1ccccc1)NC(=O)[C@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)O