THEOPHYLLINE-MEGLUMINE

Molecular Formula: C14H25N5O7


InChI: InChI=1/C7H8N4O2.C7H17NO5/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;1-8-2-4(10)6(12)7(13)5(11)3-9/h3H,1-2H3,(H,8,9);4-13H,2-3H2,1H3/f/h8H;

InChIKey: InChIKey=SYVYGLNOQIZPJI-LUXJPWOACD
SMILES: CNCC(C(C(C(CO)O)O)O)O.CN1C2=C(C(=O)N(C1=O)C)NC=N2

Names:
    THEOPHYLLINE-MEGLUMINE
    1,3-dimethyl-7H-purine-2,6-dione; 6-methylaminohexane-1,2,3,4,5-pentol
    8048-39-3

Registries:
    PubChem CID 24702
    PubChem ID 167320