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Substance Name: Alanine, N-(3-acetamido-5-methylcarbamoyl-2,4,6-triiodobenzoyl)-, DL-
RN: 57469-51-9
InChIKey: HSGXTFDCAGKVDK-UHFFFAOYSA-N

Molecular Formula

  • C14-H14-I3-N3-O5

Molecular Weight

  • 684.9806
 
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Names and Synonyms

Synonyms

  • BRN 2913622
  • DL-N-(3-Acetamido-5-methylcarbamoyl-2,4,6-triiodobenzoyl)alanine

Systematic Name

  • Alanine, N-(3-acetamido-5-methylcarbamoyl-2,4,6-triiodobenzoyl)-, DL-

Registry Numbers

CAS Registry Number

  • 57469-51-9

System Generated Number

  • 0057469519

Structure Descriptors

InChI

1S/C14H14I3N3O5/c1-4(14(24)25)19-13(23)7-8(15)6(12(22)18-3)9(16)11(10(7)17)20-5(2)21/h4H,1-3H3,(H,18,22)(H,19,23)(H,20,21)(H,24,25)

InChIKey

HSGXTFDCAGKVDK-UHFFFAOYSA-N

Smiles

CNC(=O)c1c(I)c(NC(=O)C)c(I)c(C(=O)NC(C)C(=O)O)c1I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 18500mg/kg (18500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 84, 1975.