5'-gtgagggcg-3'

Structural Information

Molecular Formula

C₈₉H₁₁₁N₄₀O₄₆P₉S₉

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=S)(O)O)N4C=NC5=C4N=C(NC5=O)N)OP(=S)(O)OCC6C(CC(O6)N7C=NC8=C7N=C(NC8=O)N)OP(=S)(O)OCC9C(CC(O9)N1C=NC2=C(N=CN=C21)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O)S

InChI

InChI=1S/C89H111N40O46P9S9/c1-31-13-122(89(139)120-75(31)131)53-6-34(44(161-53)17-153-179(144,188)170-35-8-55(162-42(35)15-150-176(140,141)185)125-26-102-62-70(125)109-83(93)115-77(62)133)169-178(143,187)155-19-46-38(10-57(164-46)127-28-104-64-72(127)111-85(95)117-79(64)135)173-182(147,191)154-18-45-36(7-54(163-45)123-24-100-60-67(91)98-23-99-68(60)123)171-181(146,190)156-20-47-39(11-58(165-47)128-29-105-65-73(128)112-86(96)118-80(65)136)174-184(149,193)158-22-49-40(12-59(167-49)129-30-106-66-74(129)113-87(97)119-81(66)137)175-183(148,192)157-21-48-37(9-56(166-48)126-27-103-63-71(126)110-84(94)116-78(63)134)172-180(145,189)152-16-43-33(5-52(160-43)121-3-2-50(90)107-88(121)138)168-177(142,186)151-14-41-32(130)4-51(159-41)124-25-101-61-69(124)108-82(92)114-76(61)132/h2-3,13,23-30,32-49,51-59,130H,4-12,14-22H2,1H3,(H,142,186)(H,143,187)(H,144,188)(H,145,189)(H,146,190)(H,147,191)(H,148,192)(H,149,193)(H2,90,107,138)(H2,91,98,99)(H,120,131,139)(H2,140,141,185)(H3,92,108,114,132)(H3,93,109,115,133)(H3,94,110,116,134)(H3,95,111,117,135)(H3,96,112,118,136)(H3,97,113,119,137)

InChIKey

WMAKIZGJPHYFDW-UHFFFAOYSA-N

Compound name

1-[4-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[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-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(dihydroxyphosphinothioyloxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16204659