[4-(6-aminopurin-9-yl)-2-[[hydroxy-(hydroxy-phosphonooxy-phosphoryl)oxy-phosphoryl]oxymethyl]-3',5'-dinitro-spiro[3,6,8-trioxabicyclo[3.3.0]octane-7,4'-cyclohexa-2,5-diene]-1'-ylidene]-dioxido-azanium

Molecular Formula: C16H16N8O19P3-


InChI: InChI=1/C16H16N8O19P3/c17-13-10-14(19-4-18-13)21(5-20-10)15-12-11(7(39-15)3-38-45(34,35)43-46(36,37)42-44(31,32)33)40-16(41-12)8(23(27)28)1-6(22(25)26)2-9(16)24(29)30/h1-2,4-5,7,11-12,15H,3H2,(H6-,17,18,19,25,26,31,32,33,34,35,36,37)/q-1/f/h31-32,34,36H,17H2

InChIKey: InChIKey=LQZBDVDATBCNNN-FBVGWCOXCC
SMILES: C1=C(C2(C(=CC1=[N+]([O-])[O-])[N+](=O)[O-])OC3C(OC(C3O2)N4C=NC5=C4N=CN=C5N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[N+](=O)[O-]

Names:
    [4-(6-aminopurin-9-yl)-2-[[hydroxy-(hydroxy-phosphonooxy-phosphoryl)oxy-phosphoryl]oxymethyl]-3',5'-dinitro-spiro[3,6,8-trioxabicyclo[3.3.0]octane-7,4'-cyclohexa-2,5-diene]-1'-ylidene]-dioxido-azanium

Registries:
    PubChem CID 4468924
    PubChem ID 6588767