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Edetate calcium disodium

Edetate calcium disodium

API0231652

Edetate calcium disodium

Edaravone is used for amyotrophic lateral sclerosis (ALS) and is an orphan drug.

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  • CAS No.

    62-33-9

  • Synonyms

    62-33-9; Edetate calcium disodium; Ethylenediaminetetraacetic acid calcium disodium salt

  • CHEMBL ID

    CHEMBL1200375

  • Molecule Type

    Small molecule

  • Compound CID

    6093170

  • Molecular Weight (g/mol)

    374.27

  • Molecular Formula

    C10H12CaN2Na2O8

  • InChI

    InChI=1S/C10H16N2O8.Ca.2Na/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;+2;2*+1/p-4

  • InChIKey

    SHWNNYZBHZIQQV-UHFFFAOYSA-J

  • SMILES

    C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Ca+2]

  • IUPAC Name

    calcium;disodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate

  • Exact Mass (Da)

    374.0014948

  • Monoisotopic Mass (Da)

    374.0014948

  • First Approval

    1953

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