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Substance Name: Samarium edetate
RN: 12611-57-3
InChIKey: CPFWKQAYWFSNFQ-UHFFFAOYSA-K

Molecular Formula

  • C10-H12-N2-O8-Sm.H

Molecular Weight

  • 439.579
 
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Names and Synonyms

  • Samarium edetate

Registry Numbers

CAS Registry Number

  • 12611-57-3

System Generated Number

  • 0012611573

Molecular Formulas

Molecular Formula

  • C10-H12-N2-O8-Sm.H

Molecular Formula Fragments

  • C10-H12-N2-O8-Sm
  • COMPONENT
  • H

Structure Descriptors

InChI

1S/C10H16N2O8.Sm/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);/q;+3/p-3

InChIKey

CPFWKQAYWFSNFQ-UHFFFAOYSA-K

Smiles

[O-]C(=O)CN(CCN(CC(=O)[O-])CC([O-])=O)CC([O-])=O.[Sm+3]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 intraperitoneal 178mg/kg (178mg/kg) LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), DIFFUSE" Archives of Environmental Health. Vol. 5, Pg. 437, 1962.
mouse LD50 intraperitoneal 311mg/kg (311mg/kg) LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), DIFFUSE" Archives of Environmental Health. Vol. 5, Pg. 437, 1962.