AIDS-122580

Molecular Formula: C44H76N18O4+6


InChI: InChI=1/C44H76N18O4/c63-55(64)39-41(51-5-17-59(18-6-51)29-25-57(26-30-59)13-1-45-2-14-57)47-37-49-43(39)53-9-21-61(22-10-53)33-35-62(36-34-61)23-11-54(12-24-62)44-40(56(65)66)42(48-38-50-44)52-7-19-60(20-8-52)31-27-58(28-32-60)15-3-46-4-16-58/h37-38,45-46H,1-36H2/q+6

InChIKey: InChIKey=LXGRHIKQZUJFAO-UHFFFAOYAG
SMILES: C1C[N+]2(CCN1)CC[N+]3(CCN(CC3)C4=C(C(=NC=N4)N5CC[N+]6(CC5)CC[N+]7(CCN(CC7)C8=NC=NC(=C8[N+](=O)[O-])N9CC[N+]1(CC9)CC[N+]3(CCNCC3)CC1)CC6)[N+](=O)[O-])CC2

Names:
    AIDS-122580
    AIDS122580
    3,12-bis[5-Nitro-6-(3,6,9,12-tetraazadispiro[5.2.5.2]hexadec-3-yl)pyrimidin-4-yl]-3,6,9,12-tetraazadispiro[5.2.5.2]hexadecane
    3,12-bis[6-(3,12-diaza-6,9-diazoniadispiro[5.2.59.26]hexadecan-3-yl)-5-nitro-pyrimidin-4-yl]-3,12-diaza-6,9-diazoniadispiro[5.2.59.26]hexadecane

Registries:
    PubChem CID 493211
    PubChem ID 218971