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Substance Name: Cyclo-bis(alanyl-glycyl-prolyl-phenylalanyl)
RN: 135755-90-7
InChIKey: NHGVYIVYSYOWIV-LVGNPMNDSA-N

Molecular Formula

  • C38-H48-N8-O8.4H2-O

Molecular Weight

  • 816.9044
 
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Names and Synonyms

Name of Substance

  • Cyclo-bis(alanyl-glycyl-prolyl-phenylalanyl)

Synonym

  • Cyclo-bis(ala-gly-pro-phe)

Systematic Name

  • Cyclo(L-alanylglycyl-L-prolyl-L-phenylalanyl-L-alanylglycyl-L-prolyl-L-phenylalanyl), tetrahydrate

Registry Numbers

CAS Registry Number

  • 135755-90-7

System Generated Number

  • 0135755907

Molecular Formulas

Molecular Formula

  • C38-H48-N8-O8.4H2-O

Molecular Formula Fragments

  • C38-H48-N8-O8
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C38H48N8O8.4H2O/c1-24(39)34(50)40-21-32(48)46-18-10-16-31(46)38(54)44-29(20-27-13-7-4-8-14-27)36(52)42-25(2)35(51)41-22-33(49)45-17-9-15-30(45)37(53)43-28(23-47)19-26-11-5-3-6-12-26;;;;/h3-8,11-14,21,23-25,28-31H,9-10,15-20,22,39H2,1-2H3,(H,41,51)(H,42,52)(H,43,53)(H,44,54);4*1H2/b40-21+;;;;/t24-,25-,28-,29-,30-,31-;;;;/m0..../s1

InChIKey

NHGVYIVYSYOWIV-LVGNPMNDSA-N

Smiles

C[C@@H](C(=O)/N=C/C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)NCC(=O)N3CCC[C@H]3C(=O)N[C@@H](Cc4ccccc4)C=O)N.O.O.O.O