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Substance Name: Benzoic acid, 3,3'-(trimethylenebis(oxyethylenecarbonylimino))bis(5-((2-oxo-1-pyrrolidinyl)methyl)-2,4,6-triiodo-
RN: 26090-57-3
InChIKey: ASSQNOFYUUPIGF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H34-I6-N4-O11

Molecular Weight

  • 1408.0496
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 26090-57-3

System Generated Number

  • 0026090573

Structure Descriptors

InChI

1S/C33H34I6N4O10/c34-24-16(14-42-8-1-4-20(42)46)26(36)30(28(38)22(24)32(48)49)40-18(44)6-12-52-10-3-11-53-13-7-19(45)41-31-27(37)17(15-43-9-2-5-21(43)47)25(35)23(29(31)39)33(50)51/h1-15H2,(H,40,44)(H,41,45)(H,48,49)(H,50,51)

InChIKey

ASSQNOFYUUPIGF-UHFFFAOYSA-N

Smiles

C1CC(=O)N(C1)Cc2c(c(c(c(c2I)NC(=O)CCOCCCOCCC(=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 9600mg/kg (9600mg/kg)   Farmaco, Edizione Scientifica. Vol. 28, Pg. 912, 1973.