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Substance Name: CP 71362
RN: 112227-15-3
InChIKey: YHLJEWZZOJLRNJ-KSCPGKLUSA-N

Molecular Formula

  • C51-H76-N8-O9

Molecular Weight

  • 945.2084
 
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Names and Synonyms

Name of Substance

  • CP 71362

Synonyms

  • Boc-phe-his-5-cyclohexylmethyl-4-hydroxy-2-isobutyl-5-aminopentanoyl-lys-phe
  • CP-71362

Systematic Name

  • L-Phenylalanine, N-(N2-(6-cyclohexyl-5-((N-(N-((1,1-dimethylethoxy)carbonyl)-L-phenylalanyl)-L-histidyl)amino)-4-hydroxy-2-(2-methylpropyl)-1-oxohexyl)-L-lysyl)-, (2R-(2R*,4S*,5S*))-

Registry Numbers

CAS Registry Number

  • 112227-15-3

System Generated Number

  • 0112227153

Structure Descriptors

InChI

1S/C51H76N8O9/c1-33(2)25-37(45(61)55-39(23-15-16-24-52)46(62)58-43(49(65)66)28-36-21-13-8-14-22-36)29-44(60)40(26-34-17-9-6-10-18-34)56-48(64)42(30-38-31-53-32-54-38)57-47(63)41(27-35-19-11-7-12-20-35)59-50(67)68-51(3,4)5/h7-8,11-14,19-22,31-34,37,39-44,60H,6,9-10,15-18,23-30,52H2,1-5H3,(H,53,54)(H,55,61)(H,56,64)(H,57,63)(H,58,62)(H,59,67)(H,65,66)/t37?,39-,40-,41-,42-,43-,44-/m0/s1

InChIKey

YHLJEWZZOJLRNJ-KSCPGKLUSA-N

Smiles

CC(C)CC(C[C@@H]([C@H](CC1CCCCC1)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc3ccccc3)NC(=O)OC(C)(C)C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc4ccccc4)C(=O)O