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Substance Name: N-(1-Carboxy-3-phenylpropyl)phenylalanine-4-aminobenzoate
RN: 140400-20-0
InChIKey: PBJMSFZKOFKHIE-UHFFFAOYSA-N

Molecular Formula

  • C26-H26-N2-O5

Molecular Weight

  • 446.5
 
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Names and Synonyms

Name of Substance

  • N-(1-Carboxy-3-phenylpropyl)phenylalanine-4-aminobenzoate

Synonyms

  • alpha-((2-((4-Carboxyphenyl)amino)-2-oxo-1-(phenylmethyl)ethyl)amino)benzenebutanoic acid
  • Cfp-F-pab
  • N-((1RS)-Carboxy-3-phenylpropyl)phe-para-aminobenzoate

Systematic Name

  • Benzenebutanoic acid, alpha-((2-((4-carboxyphenyl)amino)-2-oxo-1-(phenylmethyl)ethyl)amino)-

Registry Numbers

CAS Registry Number

  • 140400-20-0

System Generated Number

  • 0140400200

Structure Descriptors

InChI

1S/C26H26N2O5/c29-24(27-21-14-12-20(13-15-21)25(30)31)23(17-19-9-5-2-6-10-19)28-22(26(32)33)16-11-18-7-3-1-4-8-18/h1-10,12-15,22-23,28H,11,16-17H2,(H,27,29)(H,30,31)(H,32,33)

InChIKey

PBJMSFZKOFKHIE-UHFFFAOYSA-N

Smiles

c1(ccccc1)CC[C@@H](C(=O)O)N[C@@H](C(=O)Nc1ccc(cc1)C(=O)O)Cc1ccccc1