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Substance Name: Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodo-
RN: 26090-52-8
InChIKey: XDBXTDURSCEOFR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H30-I6-N4-O8

Molecular Weight

  • 1347.998
 
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Names and Synonyms

Synonyms

  • 3,3'-Pimeloyldiiminobis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodobenzoic acid)
  • 5-21-06-00379 (Beilstein Handbook Reference)
  • BRN 1523583

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 26090-52-8

System Generated Number

  • 0026090528

Structure Descriptors

InChI

1S/C31H30I6N4O8/c32-22-14(12-40-10-4-8-18(40)44)24(34)28(26(36)20(22)30(46)47)38-16(42)6-2-1-3-7-17(43)39-29-25(35)15(13-41-11-5-9-19(41)45)23(33)21(27(29)37)31(48)49/h1-13H2,(H,38,42)(H,39,43)(H,46,47)(H,48,49)

InChIKey

XDBXTDURSCEOFR-UHFFFAOYSA-N

Smiles

C1CC(=O)N(C1)Cc2c(c(c(c(c2I)NC(=O)CCCCCC(=O)Nc3c(c(c(c(c3I)C(=O)O)I)CN4CCCC4=O)I)I)C(=O)O)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 10gm/kg (10000mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.