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Substance Name: Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-
RN: 25903-29-1
InChIKey: CSEUCNSOUPZKGZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H34-I6-N4-O6

Molecular Weight

  • 1352.0296
 
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Names and Synonyms

Synonym

  • 3,3'-Pimeloyldiiminobis(5-(butyramidomethyl)-2,4,6-triiodobenzoic acid)

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 25903-29-1

System Generated Number

  • 0025903291

Structure Descriptors

InChI

1S/C31H34I6N4O8/c1-3-8-16(42)38-12-14-22(32)20(30(46)47)26(36)28(24(14)34)40-18(44)10-6-5-7-11-19(45)41-29-25(35)15(13-39-17(43)9-4-2)23(33)21(27(29)37)31(48)49/h3-13H2,1-2H3,(H,38,42)(H,39,43)(H,40,44)(H,41,45)(H,46,47)(H,48,49)

InChIKey

CSEUCNSOUPZKGZ-UHFFFAOYSA-N

Smiles

CCCC(=O)NCc1c(c(c(c(c1I)NC(=O)CCCCCC(=O)Nc2c(c(c(c(c2I)C(=O)O)I)CNC(=O)CCC)I)I)C(=O)O)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 4900mg/kg (4900mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.