5'-gagtgggca-3'

Structural Information

Molecular Formula

C₈₉H₁₁₁N₄₀O₄₅P₉S₉

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OC3CC(OC3COP(=S)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5COP(=S)(O)O)N6C=NC7=C6N=C(NC7=O)N)N8C=NC9=C(N=CN=C98)N)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=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=C(N=CN=C21)N)O)S

InChI

InChI=1S/C89H111N40O45P9S9/c1-32-13-122(89(138)120-77(32)131)54-6-35(45(160-54)17-152-180(145,189)172-39-10-58(127-29-106-65-74(127)112-85(95)117-80(65)134)164-48(39)20-155-181(146,190)170-37-7-55(124-26-103-62-69(92)99-24-101-71(62)124)162-46(37)18-153-178(143,187)169-36-8-56(161-43(36)15-149-175(139,140)184)125-27-104-63-72(125)110-83(93)115-78(63)132)168-177(142,186)154-19-47-40(11-59(163-47)128-30-107-66-75(128)113-86(96)118-81(66)135)173-182(147,191)157-22-50-41(12-60(166-50)129-31-108-67-76(129)114-87(97)119-82(67)136)174-183(148,192)156-21-49-38(9-57(165-49)126-28-105-64-73(126)111-84(94)116-79(64)133)171-179(144,188)151-16-44-34(5-53(159-44)121-3-2-51(90)109-88(121)137)167-176(141,185)150-14-42-33(130)4-52(158-42)123-25-102-61-68(91)98-23-100-70(61)123/h2-3,13,23-31,33-50,52-60,130H,4-12,14-22H2,1H3,(H,141,185)(H,142,186)(H,143,187)(H,144,188)(H,145,189)(H,146,190)(H,147,191)(H,148,192)(H2,90,109,137)(H2,91,98,100)(H2,92,99,101)(H,120,131,138)(H2,139,140,184)(H3,93,110,115,132)(H3,94,111,116,133)(H3,95,112,117,134)(H3,96,113,118,135)(H3,97,114,119,136)

InChIKey

MVBKXYDEVCVHGL-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16204636