TOE

Molecular Formula: C₁₉H₂₅N₅O₅

InChI: InChI=1/C10H15NO.C9H10N4O4/c1-8(11-2)10(12)9-6-4-3-5-7-9;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h3-8,10-12H,1-2H3;4H,3H2,1-2H3,(H,14,15)/t8-,10-;/m0./s1/f/h;14H

InChIKey: InChIKey=YSIIKGUQUONBTG-PFIDGXKMDL
SMILES: CC(C(C1=CC=CC=C1)O)NC.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O

Names:
    EINECS 249-783-2
    Ephedrine theophylline 7-acetate
    Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with (-)-ephedrine (1:1)
    Teofilino-7-octanefedryny [Polish]
    TOE
    1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid,compound with (R-(R,S))-alpha-(1-(methylamino)ethyl)benzyl alcoho l (1:1)
    2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid; (1S,2S)-2-methylamino-1-phenyl-propan-1-ol
    29701-08-4

Registries:
    PubChem CID 71289
    PubChem ID 213513