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Substance Name: Tetragastrin, iso-asp(3)-
RN: 82392-97-0
InChIKey: CIPNOQWGJZANPC-WMIMKTLMSA-N

Note

  • Isoaspartyl peptide configuration given in first source.

Molecular Formula

  • C29-H36-N6-O6-S

Molecular Weight

  • 596.7054
 
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Names and Synonyms

Name of Substance

  • Tetragastrin, iso-asp(3)-

Synonyms

  • 3-Iso-asp-tetragastrin
  • L-Tryptophyl-L-methionyl-L-beta-aspartyl-L-phenylalaninamide
  • Tetragastrin, isoaspartic acid(3)-

Systematic Name

  • L-Phenylalaninamide, L-tryptophyl-L-methionyl-L-beta-aspartyl-

Registry Numbers

CAS Registry Number

  • 82392-97-0

System Generated Number

  • 0082392970

Structure Descriptors

InChI

1S/C29H36N6O6S/c1-42-12-11-23(34-26(37)20(30)14-18-16-32-22-10-6-5-9-19(18)22)27(38)35-28(39)24(13-17-7-3-2-4-8-17)33-25(36)15-21(31)29(40)41/h2-10,16,20-21,23-24,32H,11-15,30-31H2,1H3,(H,33,36)(H,34,37)(H,40,41)(H,35,38,39)/t20-,21-,23-,24-/m0/s1

InChIKey

CIPNOQWGJZANPC-WMIMKTLMSA-N

Smiles

CSCC[C@@H](C(=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)C[C@@H](C(=O)O)N)NC(=O)[C@H](Cc2c[nH]c3c2cccc3)N