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Substance Name: (2R,3S,4S)-N-(2-(Benzylamino)-4-((N-((benzyloxy)carbonyl)valyl)amino)-3-hydroxy-5-phenylpentanoyl)-L-leucine benzylamide
RN: 161510-49-2
InChIKey: WZBLEGUFGOUOBE-PLXHNDKISA-N

Molecular Formula

  • C44-H55-N5-O6

Molecular Weight

  • 749.9475
 
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Names and Synonyms

  • (2R,3S,4S)-N-(2-(Benzylamino)-4-((N-((benzyloxy)carbonyl)valyl)amino)-3-hydroxy-5-phenylpentanoyl)-L-leucine benzylamide

Registry Numbers

CAS Registry Number

  • 161510-49-2

System Generated Number

  • 0161510492

Structure Descriptors

InChI

1S/C44H55N5O6/c1-30(2)25-37(41(51)46-28-34-21-13-7-14-22-34)48-43(53)39(45-27-33-19-11-6-12-20-33)40(50)36(26-32-17-9-5-10-18-32)47-42(52)38(31(3)4)49-44(54)55-29-35-23-15-8-16-24-35/h5-24,30-31,36-40,45,50H,25-29H2,1-4H3,(H,46,51)(H,47,52)(H,48,53)(H,49,54)/t36-,37-,38-,39+,40+/m0/s1

InChIKey

WZBLEGUFGOUOBE-PLXHNDKISA-N

Smiles

CC(C)C[C@@H](C(=O)NCc1ccccc1)NC(=O)[C@@H]([C@@H]([C@H](Cc2ccccc2)NC(=O)[C@H](C(C)C)NC(=O)OCc3ccccc3)O)NCc4ccccc4