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Substance Name: Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester
RN: 112317-45-0
InChIKey: OHFBCDFWQFKELV-KNIQQNQGSA-N

Molecular Formula

  • C38-H52-N8-O8

Molecular Weight

  • 748.8768
 
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Names and Synonyms

Name of Substance

  • Phenylalanyl-glycyl-histidyl-statyl-alanyl-phenylalanine methyl ester

Synonyms

  • Hexapeptide 4
  • NH2-Phe-gly-his-sta-ala-phe-ome

Systematic Name

  • L-Phenylalanine, N-(N-(3-hydroxy-6-methyl-1-oxo-4-((N-(N-L-phenylalanylglycyl)-L-histidyl)amino)heptyl)-L-alanyl)-, methyl ester, (S-(R*,R*))-

Registry Numbers

CAS Registry Number

  • 112317-45-0

System Generated Number

  • 0112317450

Structure Descriptors

InChI

1S/C38H52N8O8/c1-23(2)15-29(32(47)19-33(48)43-24(3)35(50)46-31(38(53)54-4)17-26-13-9-6-10-14-26)45-37(52)30(18-27-20-40-22-42-27)44-34(49)21-41-36(51)28(39)16-25-11-7-5-8-12-25/h5-14,20,22-24,28-32,47H,15-19,21,39H2,1-4H3,(H,40,42)(H,41,51)(H,43,48)(H,44,49)(H,45,52)(H,46,50)/t24-,28-,29-,30-,31-,32-/m0/s1

InChIKey

OHFBCDFWQFKELV-KNIQQNQGSA-N

Smiles

C[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)OC)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)CNC(=O)[C@H](Cc3ccccc3)N)O