.beta.-Methylene SAD

Molecular Formula: C₂₀H₂₇N₇O₁₃P₂Se

InChI: InChI=1/C20H27N7O13P2Se/c21-16-10-18(24-4-23-16)27(5-25-10)20-14(31)12(29)9(40-20)2-38-42(35,36)6-41(33,34)37-1-8-11(28)13(30)15(39-8)19-26-7(3-43-19)17(22)32/h3-5,8-9,11-15,20,28-31H,1-2,6H2,(H2,22,32)(H,33,34)(H,35,36)(H2,21,23,24)/t8-,9-,11-,12-,13-,14-,15-,20-/m1/s1/f/h33,35H,21-22H2

InChIKey: InChIKey=BQVYVGJIUMNETO-MEFLTKTKDA
SMILES: C1=C(N=C([Se]1)C2C(C(C(O2)COP(=O)(CP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)O)C(=O)N

Names:
    AIDS-131102
    AIDS131102
    NSC621959
    .beta.-Methylene SAD
    4-Carboxamido-2-.beta.-D-ribofuranosylselenazolyl(5'+5') adenosine methylenediphosphonic acid
    [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-[[[(2R,3S,4R,5R)-5-(4-carbamoyl-1,3-selenazol-2-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]methyl]phosphinic acid

Registries:
    PubChem CID 158551
    PubChem ID 227051