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Substance Name: Benzoic acid, 3,3'-(sebacoyldiimino)bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodo-
RN: 26090-51-7
InChIKey: LOTQQEICNRTHIX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C34-H36-I6-N4-O8

Molecular Weight

  • 1390.08
 
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Names and Synonyms

Synonyms

  • 3,3'-(Sebacoyldiimino)bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodobenzoic acid)
  • 5-21-06-00379 (Beilstein Handbook Reference)
  • BRN 1523595

Systematic Name

  • Benzoic acid, 3,3'-(sebacoyldiimino)bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 26090-51-7

System Generated Number

  • 0026090517

Structure Descriptors

InChI

1S/C34H36I6N4O8/c35-25-17(15-43-13-7-11-21(43)47)27(37)31(29(39)23(25)33(49)50)41-19(45)9-5-3-1-2-4-6-10-20(46)42-32-28(38)18(16-44-14-8-12-22(44)48)26(36)24(30(32)40)34(51)52/h1-16H2,(H,41,45)(H,42,46)(H,49,50)(H,51,52)

InChIKey

LOTQQEICNRTHIX-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)c(c1I)C(O)=O)NC(CCCCCCCCC(Nc1c(c(c(I)c(c1I)C(O)=O)CN1C(CCC1)=O)I)=O)=O)I)CN1C(CCC1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 2300mg/kg (2300mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.