Sodium methotrexate

PubChem Notes:

Methotrexate An antineoplastic antimetabolite with immunosuppressant properties. It is an inhibitor of TETRAHYDROFOLATE DEHYDROGENASE and prevents the formation of tetrahydrofolate, necessary for synthesis of thymidylate, an essential component of DNA.

Molecular Formula: C20H20N8Na2O5


InChI: InChI=1/C20H22N8O5.2Na/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30;;/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27);;/q;2*+1/p-2/fC20H20N8O5.2Na/h25H,21-22H2;;/q-2;2m

InChIKey: InChIKey=DASQOOZCTWOQPA-XRFJMVIGCO
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)[O-].[Na+].[Na+]

Names:
    Abitrexate
    Amethopterin sodium
    Disodium methotrexate
    disodium 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]pentanedioate
    Farmitrexat
    Ledertrexate
    Methotrexate disodium salt
    METHOTREXATE SODIUM
    Methotrexat dinatrium
    MTX disodium
    Sodium methotrexate

Registries:
    PubChem CID 23893
    PubChem ID 166420