THEOBROMINE MAGNESIUM OLEATE

Molecular Formula: C₂₅H₄₀MgN₄O₄

InChI: InChI=1/C18H34O2.C7H8N4O2.Mg/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-10-3-8-5-4(10)6(12)9-7(13)11(5)2;/h8-9H,2-7,10-17H2,1H3,(H,19,20);3H,1-2H3,(H,9,12,13);/q;;+2/p-2/b9-8-;;/fC18H33O2.C7H7N4O2.Mg/q2*-1;m

InChIKey: InChIKey=FORQFXHCWZQDEZ-BBDODRDVDD
SMILES: CCCCCCCC=CCCCCCCCCC(=O)[O-].CN1C=NC2=C1C(=O)N=C(N2C)[O-].[Mg+2]

Names:
    EINECS 229-826-1
    magnesium; 3,7-dimethyl-6-oxo-purin-2-olate; (Z)-octadec-10-enoate
    THEOBROMINE MAGNESIUM OLEATE
    (3,7-Dihydro-3,7-dimethyl-1H-purine-2,6-dionato-N1)(oleato-O)magnesium
    6767-73-3

Registries:
    PubChem CID 6433486
    PubChem ID 165796