MERCUROPHYLLINE

Molecular Formula: C₂₁H₃₃HgN₅NaO₇

InChI: InChI=1/C14H24NO4.C7H8N4O2.Hg.Na.H2O/c1-9(19-5)8-15-11(16)10-6-7-14(4,12(17)18)13(10,2)3;1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;;;/h9-10H,1,6-8H2,2-5H3,(H,15,16)(H,17,18);3H,1-2H3,(H,8,9);;;1H2/q;;;+1;/p-1/fC14H23NO4.C7H8N4O2.Hg.Na.H2O/h15H;8H;;;/q-1;;;m;/rC14H24HgNO4.C7H8N4O2.Na.H2O/c1-13(2)10(5-6-14(13,3)12(18)19)11(17)16-8-9(7-15)20-4;1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;;/h9-10H,5-8H2,1-4H3,(H,16,17)(H,18,19);3H,1-2H3,(H,8,9);;1H2/q;;+1;/p-1/fC14H23HgNO4.C7H8N4O2.Na.H2O/h16H;8H;;/q-1;;m;

InChIKey: InChIKey=ZWSLSSFBEKAIBX-LSFYOCLICS
SMILES: CC1(C(CCC1(C)C(=O)[O-])C(=O)NCC(C[Hg])OC)C.CN1C2=C(C(=O)N(C1=O)C)NC=N2.O.[Na+]

Names:
    MERCUROPHYLLINE
    sodium; [3-[(3-carboxylato-2,2,3-trimethyl-cyclopentanecarbonyl)amino]-2-methoxy-propyl]mercury; 1,3-dimethyl-7H-purine-2,6-dione; hydrate
    124-82-3

Registries:
    PubChem CID 11947674
    PubChem ID 173362