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Substance Name: Snf 8702
RN: 129228-52-0
InChIKey: PXEWXFWGIMIUKJ-TZLMNZOISA-N

Molecular Formula

  • C53-H70-N10-O13

Molecular Weight

  • 1055.19
 
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Names and Synonyms

Name of Substance

  • Snf 8702

Synonyms

  • Cholecystokinin (26-33), N-methyl-nle(28,31)-
  • Cholecystokinin (26-33), N-methylnorleucine(28,31)-
  • L-alpha-Aspartyl-L-tyrosyl-N-methyl-L-norleucylglycyl-L-tryptophyl-N-methyl-L-norleucyl-L-alpha-aspartyl-L-phenylalaninamide
  • N-Methyl-28,31-nle-cholecystokinin (26-33)
  • Snf-8702

Systematic Name

  • L-Phenylalaninamide, L-alpha-aspartyl-L-tyrosyl-N-methyl-L-norleucylglycyl-L-tryptophyl-N-methyl-L-norleucyl-L-alpha-aspartyl-

Registry Numbers

CAS Registry Number

  • 129228-52-0

System Generated Number

  • 0129228520

Structure Descriptors

InChI

1S/C53H70N10O13/c1-5-7-17-38(55-3)48(71)58-30-44(65)59-43(26-33-29-57-37-19-13-12-16-35(33)37)53(76)63(51(74)41(25-32-20-22-34(64)23-21-32)61-47(70)36(54)27-45(66)67)52(75)42(24-31-14-10-9-11-15-31)62-50(73)40(28-46(68)69)60-49(72)39(56-4)18-8-6-2/h9-16,19-23,29,36,38-43,55-57,64H,5-8,17-18,24-28,30,54H2,1-4H3,(H,58,71)(H,59,65)(H,60,72)(H,61,70)(H,62,73)(H,66,67)(H,68,69)/t36-,38-,39-,40-,41-,42-,43-/m0/s1

InChIKey

PXEWXFWGIMIUKJ-TZLMNZOISA-N

Smiles

C([C@@H](NC([C@@H](NC([C@@H](NC)CCCC)=O)CC(=O)O)=O)Cc1ccccc1)(=O)N(C([C@@H](NC(CNC([C@@H](NC)CCCC)=O)=O)Cc1c[nH]c2ccccc12)=O)C([C@@H](NC([C@@H](N)CC(=O)O)=O)Cc1ccc(O)cc1)=O