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Substance Name: (Phenylmethoxy)carbonylcysteinyl(phenylmethyl)-tyrosyl-isoleucine tert-butyl ester
RN: 52668-03-8
InChIKey: BYWIJKHLRLGPGA-ACRCOBMYSA-N

Note

  • Carboxyl-protected form of the N-terminal tripeptide of oxytocin.

Molecular Formula

  • C37-H47-N3-O7-S

Molecular Weight

  • 677.8583
 
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Names and Synonyms

Name of Substance

  • (Phenylmethoxy)carbonylcysteinyl(phenylmethyl)-tyrosyl-isoleucine tert-butyl ester

Synonyms

  • Bz-Cti-otbu
  • Z-Cys(bzl)-tyr-ile-otbu

Systematic Name

  • L-Isoleucine, N-(N-(N-((phenylmethoxy)carbonyl)-S-(phenylmethyl)-L-cysteinyl)-L-tyrosyl)-, 1,1-dimethylethyl ester

Registry Numbers

CAS Registry Number

  • 52668-03-8

System Generated Number

  • 0052668038

Structure Descriptors

InChI

1S/C37H47N3O7S/c1-6-25(2)32(35(44)47-37(3,4)5)40-33(42)30(21-26-17-19-29(41)20-18-26)38-34(43)31(24-48-23-28-15-11-8-12-16-28)39-36(45)46-22-27-13-9-7-10-14-27/h7-20,25,30-32,41H,6,21-24H2,1-5H3,(H,38,43)(H,39,45)(H,40,42)/t25-,30-,31-,32-/m0/s1

InChIKey

BYWIJKHLRLGPGA-ACRCOBMYSA-N

Smiles

CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](CSCc2ccccc2)NC(=O)OCc3ccccc3