[[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [5-[7,8-dimethyl-2,4-dioxo-5-(3-phenylpropanoyl)-1H-benzo[g]pteridin-10-yl]-2,3,4-trihydroxy-pentyl] hydrogen phosphate

More details:

• Systematic name

  [[5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [5-[7,8-dimethyl-2,4-dioxo-5-(3-phenylpropanoyl)-1H-benzo[g]pteridin-10-yl]-2,3,4-trihydroxy-pentyl] hydrogen phosphate

• SMILES

  Cc1cc2c(cc1C)N(c3c([nH]c(=O)[nH]c3=O)N2CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)n5cnc6c5ncnc6N)O)O)O)O)O)C(=O)CCc7ccccc7

• Std. InChi

  InChI=1S/C36H43N9O16P2/c1-17-10-20-21(11-18(17)2)45(25(48)9-8-19-6-4-3-5-7-19)27-33(41-36(53)42-34(27)52)43(20)12-22(46)28(49)23(47)13-58-62(54,55)61-63(56,57)59-14-24-29(50)30(51)35(60-24)44-16-40-26-31(37)38-15-39-32(26)44/h3-7,10-11,15-16,22-24,28-30,35,46-47,49-51H,8-9,12-14H2,1-2H3,(H,54,55)(H,56,57)(H2,37,38,39)(H2,41,42,52,53)

• Std. InChIKey

  ASOSNULLFLNYFZ-UHFFFAOYSA-N

• Cite this record

  CSID:22377123, http://www.chemspider.com/Chemical-Structure.22377123.html (accessed 12:34, Apr 16, 2024)