[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(2,4,6-trinitrophenoxy)oxolan-2-yl]methoxyphosphonic acid

Molecular Formula: C22H16N11O19P


InChI: InChI=1/C22H16N11O19P/c23-20-15-21(25-6-24-20)27(7-26-15)22-19(52-17-12(32(42)43)3-9(29(36)37)4-13(17)33(44)45)18(14(50-22)5-49-53(46,47)48)51-16-10(30(38)39)1-8(28(34)35)2-11(16)31(40)41/h1-4,6-7,14,18-19,22H,5H2,(H2,23,24,25)(H2,46,47,48)/t14-,18-,19-,22-/m1/s1/f/h46-47H,23H2

InChIKey: InChIKey=AMVUEJDXAXQGEC-VQPYKILXDD
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])OC2C(OC(C2OC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N4C=NC5=C4N=CN=C5N)COP(=O)(O)O)[N+](=O)[O-])[N+](=O)[O-]

Names:
    [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(2,4,6-trinitrophenoxy)oxolan-2-yl]methoxyphosphonic acid

Registries:
    PubChem CID 11765703
    PubChem ID 16873750