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Substance Name: Proline, 1-(4-(((2-carboxybutyl)amino)carbonyl)-2,3,5,6-tetraiodobenzoyl)-
RN: 29820-40-4
InChIKey: GGYOQFVWWZRFAB-MQWKRIRWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H18-I4-N2-O6

Molecular Weight

  • 865.948
 
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Names and Synonyms

Synonyms

  • 1-(4-(((2-Carboxybutyl)amino)carbonyl)-2,3,5,6-tetraiodobenzoyl)proline
  • alpha-(4-(2-Carboxy-pyrrolidino)-carbonyl-2,3,5,6-tetrajod-benzoyl-amidomethyl)-buttersaure
  • BRN 0504482

Systematic Name

  • Proline, 1-(4-(((2-carboxybutyl)amino)carbonyl)-2,3,5,6-tetraiodobenzoyl)-

Registry Numbers

CAS Registry Number

  • 29820-40-4

System Generated Number

  • 0029820404

Structure Descriptors

InChI

1S/C18H18I4N2O6/c1-2-7(17(27)28)6-23-15(25)9-11(19)13(21)10(14(22)12(9)20)16(26)24-5-3-4-8(24)18(29)30/h7-8H,2-6H2,1H3,(H,23,25)(H,27,28)(H,29,30)/t7?,8-/m0/s1

InChIKey

GGYOQFVWWZRFAB-MQWKRIRWSA-N

Smiles

C([C@H]1N(CCC1)C(c1c(c(c(c(c1I)I)C(=O)NC[C@@H](CC)C(=O)O)I)I)=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4gm/kg (4000mg/kg)   Helvetica Chimica Acta. Vol. 54, Pg. 2097, 1971.