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Substance Name: Iotroxic acid [USAN:INN:BAN:JAN]
RN: 51022-74-3
UNII: 84C5PTP9X6
InChIKey: JXMIBUGMYLQZGO-UHFFFAOYSA-N

Classification Codes

  • Diagnostic Aid (Radiopaque Medium)
  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H18-I6-N2-O9

Molecular Weight

  • 1215.79
 
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Names and Synonyms

Name of Substance

  • Iotroxic acid
  • Iotroxic acid [USAN:INN:BAN:JAN]

Synonyms

  • 3,3'-(2,2'-Oxydiethylenedioxybisacetamido)bis(2,4,6-triiodobenzoic acid)
  • 3,3'-(3,6,9-Trioxaundecanedioyldiamino)bis(2,4,6-triiodobenzoic acid)
  • 3,3'-(Oxybis(ethyleneoxymethylenecarbonylimino))bis(2,4,6-triiodobenzoic acid)
  • Acide iotroxique
  • Acide iotroxique [INN-French]
  • Acido iotroxico
  • Acido iotroxico [INN-Spanish]
  • Acidum iotroxicum
  • Acidum iotroxicum [INN-Latin]
  • Benzoic acid, 3,3'-(oxybis(2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino))bis(2,4,6, triiodo-
  • Biliscopin
  • BRN 2800081
  • EINECS 256-917-3
  • Iotroxic acid
  • Iotroxinsaeure
  • Iotroxinsaeure [German]
  • SH 213 AB
  • SH 213AB
  • UNII-84C5PTP9X6

Systematic Names

  • 3,3'-(Oxybis(2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino)bis(2,4,6-triiodobenzoic acid)
  • Benzoic acid, 3,3'-(oxybis(2,1-ethanediyloxy(1-oxo-2,1-ethanediyl)imino))bis(2,4,6-triiodo-
  • Iotroxic acid

Registry Numbers

CAS Registry Number

  • 51022-74-3

FDA UNII

  • 84C5PTP9X6

System Generated Number

  • 0051022743

Structure Descriptors

InChI

1S/C22H18I6N2O9/c23-9-5-11(25)19(17(27)15(9)21(33)34)29-13(31)7-38-3-1-37-2-4-39-8-14(32)30-20-12(26)6-10(24)16(18(20)28)22(35)36/h5-6H,1-4,7-8H2,(H,29,31)(H,30,32)(H,33,34)(H,35,36)

InChIKey

JXMIBUGMYLQZGO-UHFFFAOYSA-N

Smiles

c1(c(c(c(I)cc1I)C(O)=O)I)NC(COCCOCCOCC(Nc1c(c(c(I)cc1I)C(O)=O)I)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intracrebral 50mg/kg (50mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
mouse LD50 intraperitoneal 5250mg/kg (5250mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 13, Pg. 637, 1982.
mouse LD50 intravenous 2820mg/kg (2820mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 13, Pg. 637, 1982.
mouse LD50 oral > 9gm/kg (9000mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
mouse LD50 subcutaneous 6150mg/kg (6150mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 intravenous 4190mg/kg (4190mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 13, Pg. 637, 1982.
rat LD50 oral > 9gm/kg (9000mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 24, Pg. 695, 1982.
rat LD50 subcutaneous 7100mg/kg (7100mg/kg)   Iyakuhin Kenkyu. Study of Medical Supplies. Vol. 13, Pg. 637, 1982.