Identifiers

• Canonical SMILES:

  NC1=Nc2n(cnc2C(=O)N1)[C@@H]3OC[C@H](O[P](O)(=O)n4cc[n+](c4N)[P](O)(=O)O[C@H]5CO[C@H]([C@@H]5O)n6cnc7C(=O)NC(=Nc67)N)[C@H]3O

• IUPAC name:

  2-amino-3-[(R)-{[(3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-4-hydroxyoxolan-3-yl]oxy}(hydroxy)phosphoryl]-1-[(S)-{[(3S,4R,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-4-hydroxyoxolan-3-yl]oxy}(hydroxy)phosphoryl]-1H-imidazol-3-ium

• InChi:

  InChI=1S/C21H25N13O12P2/c22-19-27-13-9(15(37)29-19)25-5-31(13)17-11(35)7(3-43-17)45-47(39,40)33-1-2-34(21(33)24)48(41,42)46-8-4-44-18(12(8)36)32-6-26-10-14(32)28-20(23)30-16(10)38/h1-2,5-8,11-12,17-18,24,35-36H,3-4H2,(H8,22,23,27,28,29,30,37,38,39,40,41,42)/p+1/t7-,8-,11+,12+,17+,18+/m0/s1

• InChiKey:

  ZVPUVGSJWNSRDP-QIHYXNHISA-O

• SMARTS:

  [#7]-[#6]1:[#7]:[#6]2:[#7](:[#6]:[#7]:[#6]:2:[#6](=[#8]):[#7]:1)-[#6@@H]1-[#8]-[#6]-[#6@H](-[#8]-[#15](-[#8])(=[#8])-[#7]2:[#6]:[#6]:[#7+](:[#6]:2-[#7])-[#15](-[#8])(=[#8])-[#8]-[#6@H]2-[#6]-[#8]-[#6@H](-[#6@@H]-2-[#8])-[#7]2:[#6]:[#7]:[#6]3:[#6](=[#8]):[#7]:[#6](:[#7]:[#6]:2:3)-[#7])-[#6@H]-1-[#8]

Chemistry rules

External links

155289235 Q1V

RNA-SM complexes