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Substance Name: Benzoic acid, 3,3'-(oxybis(ethyleneoxyethylenecarbonylimino))bis(5-(methylcarbamoyl)-2,4,6-triiodo-
RN: 51211-02-0
InChIKey: IADUEKFIZPXZGK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H28-I6-N4-O11

Molecular Weight

  • 1357.95
 
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Names and Synonyms

Synonym

  • BRN 2800767

Systematic Name

  • Benzoic acid, 3,3'-(oxybis(ethyleneoxyethylenecarbonylimino))bis(5-(methylcarbamoyl)-2,4,6-triiodo-

Registry Numbers

CAS Registry Number

  • 51211-02-0

System Generated Number

  • 0051211020

Structure Descriptors

InChI

1S/C28H28I6N4O11/c1-35-25(41)13-17(29)15(27(43)44)21(33)23(19(13)31)37-11(39)3-5-47-7-9-49-10-8-48-6-4-12(40)38-24-20(32)14(26(42)36-2)18(30)16(22(24)34)28(45)46/h3-10H2,1-2H3,(H,35,41)(H,36,42)(H,37,39)(H,38,40)(H,43,44)(H,45,46)

InChIKey

IADUEKFIZPXZGK-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)c(c1I)C(O)=O)C(NC)=O)I)NC(CCOCCOCCOCCC(Nc1c(c(c(I)c(c1I)C(O)=O)C(NC)=O)I)=O)=O

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.