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Substance Name: DL-Phenylalanine, beta-hydroxy-3-(((2-hydroxyphenyl)methylene)amino)-N-(phenylacetyl)-, sodium salt, threo-
RN: 117490-93-4
InChIKey: KEAJFMCMTNUVQI-DJVDJOMVSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H21-N2-O5.Na

Molecular Weight

  • 440.4289
 
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Names and Synonyms

Synonym

  • N(sup alpha)-Phenylacetyl-N-m-salicylidene-threo-DL-phenylserine sodium salt

Systematic Name

  • DL-Phenylalanine, beta-hydroxy-3-(((2-hydroxyphenyl)methylene)amino)-N-(phenylacetyl)-, sodium salt, threo-

Registry Numbers

CAS Registry Number

  • 117490-93-4

System Generated Number

  • 0117490934

Molecular Formulas

Molecular Formula

  • C24-H21-N2-O5.Na

Molecular Formula Fragments

  • C24-H21-N2-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C24H22N2O5.Na/c27-20-12-5-4-9-18(20)15-25-19-11-6-10-17(14-19)23(29)22(24(30)31)26-21(28)13-16-7-2-1-3-8-16;/h1-12,14-15,22-23,27,29H,13H2,(H,26,28)(H,30,31);/q;+1/p-1/b25-15+;/t22-,23?;/m1./s1

InChIKey

KEAJFMCMTNUVQI-DJVDJOMVSA-M

Smiles

c1ccc(cc1)CC(=O)N[C@H](C(c2cccc(c2)/N=C/c3ccccc3O)O)C(=O)[O-].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2420mg/kg (2420mg/kg)   Pharmaceutical Chemistry Journal Vol. 22, Pg. 637, 1988.