2'-O-Acetyladenosine - 2-O-[hydroxy(phosphonooxy)phosphoryl]-D-ribose (1:1)

More details:

• Systematic name

  [(2R,3R,4R,5R)-2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-3-yl] acetate;[(1R,2R,3R)-1-formyl-2,3,4-trihydroxy-butyl] phosphono hydrogen phosphate

• SMILES

  CC(=O)O[C@@H]1[C@@H]([C@H](O[C@H]1n2cnc3c2ncnc3N)CO)O.C([C@H]([C@H]([C@H](C=O)OP(=O)(O)OP(=O)(O)O)O)O)O

• Std. InChi

  InChI=1S/C12H15N5O5.C5H12O11P2/c1-5(19)21-9-8(20)6(2-18)22-12(9)17-4-16-7-10(13)14-3-15-11(7)17;6-1-3(8)5(9)4(2-7)15-18(13,14)16-17(10,11)12/h3-4,6,8-9,12,18,20H,2H2,1H3,(H2,13,14,15);2-6,8-9H,1H2,(H,13,14)(H2,10,11,12)/t6-,8-,9-,12-;3-,4+,5-/m11/s1

• Std. InChIKey

  NJXMLJLKUKWCLL-QNCMOSBPSA-N

• Cite this record

  CSID:29545254, http://www.chemspider.com/Chemical-Structure.29545254.html (accessed 12:53, Apr 25, 2024)