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Substance Name: Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(propionamidomethyl)-2,4,6-triiodo-
RN: 25901-45-5
InChIKey: BTEMSWZIWBJGBC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H30-I6-N4-O8

Molecular Weight

  • 1323.98
 
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Names and Synonyms

Synonyms

  • 3,3'-(Pimeloyldiimino)bis(5-(propionamidomethyl)-2,4,6-triiodobenzoic acid)
  • BRN 2800721

Systematic Name

  • Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(propionamidomethyl)-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 25901-45-5

System Generated Number

  • 0025901455

Structure Descriptors

InChI

1S/C29H30I6N4O8/c1-3-14(40)36-10-12-20(30)18(28(44)45)24(34)26(22(12)32)38-16(42)8-6-5-7-9-17(43)39-27-23(33)13(11-37-15(41)4-2)21(31)19(25(27)35)29(46)47/h3-11H2,1-2H3,(H,36,40)(H,37,41)(H,38,42)(H,39,43)(H,44,45)(H,46,47)

InChIKey

BTEMSWZIWBJGBC-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)c(c1I)CNC(CC)=O)C(O)=O)I)NC(CCCCCC(Nc1c(c(c(I)c(c1I)CNC(CC)=O)C(O)=O)I)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8gm/kg (8000mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.