5'-d[ttgoggogtospt]-3'

Structural Information

Molecular Formula

C₈₀H₁₀₁N₂₈O₄₆P₇S₄

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=S)(O)OC9CC(OC9CO)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)S)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)O

InChI

InChI=1S/C80H101N28O46P7S4/c1-29-13-101(77(119)97-65(29)111)49-5-33(110)42(141-49)18-136-158(129,162)152-38-10-52(104-16-32(4)68(114)100-80(104)122)142-43(38)19-133-156(125,126)149-36-8-53(105-25-85-57-61(105)89-73(81)93-69(57)115)146-47(36)23-138-161(132,165)154-40-12-56(108-28-88-60-64(108)92-76(84)96-72(60)118)145-45(40)21-135-157(127,128)150-37-9-54(106-26-86-58-62(106)90-74(82)94-70(58)116)147-48(37)24-139-160(131,164)153-39-11-55(107-27-87-59-63(107)91-75(83)95-71(59)117)144-44(39)20-134-155(123,124)148-35-7-51(103-15-31(3)67(113)99-79(103)121)143-46(35)22-137-159(130,163)151-34-6-50(140-41(34)17-109)102-14-30(2)66(112)98-78(102)120/h13-16,25-28,33-56,109-110H,5-12,17-24H2,1-4H3,(H,123,124)(H,125,126)(H,127,128)(H,129,162)(H,130,163)(H,131,164)(H,132,165)(H,97,111,119)(H,98,112,120)(H,99,113,121)(H,100,114,122)(H3,81,89,93,115)(H3,82,90,94,116)(H3,83,91,95,117)(H3,84,92,96,118)

InChIKey

ZMVKRGUCJNFSOG-UHFFFAOYSA-N

Compound name

[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[hydroxy-[[3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methyl [2-[[hydroxy-[2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxyphosphinothioyl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hydrogen phosphate

Related CIDs

• CID 16204551