MOLI001089

Molecular Formula: C₁₅H₂₂N₆O₅S

InChI: InChI=1/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/i1-1/f/h17H2

InChIKey: InChIKey=MEFKEPWMEQBLKI-JDJNKIMSGT
SMILES: C[S+](CCC(C(=O)[O-])N)CC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)O

Names:
    MOLI001089
    2-amino-4-[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl-methyl-sulfonio]butanoate

Registries:
    PubChem CID 450572
    PubChem ID 1039