5'-gagtggttg-3'

Structural Information

Molecular Formula

C₉₀H₁₁₃N₃₆O₄₈P₉S₉

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)OC6CC(OC6COP(=S)(O)OC7CC(OC7COP(=O)(OC8CC(OC8COP(=S)(O)OC9CC(OC9COP(=S)(O)O)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C(N=CN=C21)N)S)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C90H113N36O48P9S9/c1-32-13-118(88(136)115-75(32)128)54-5-36(167-176(141,185)150-16-44-35(127)4-53(158-44)122-27-100-63-70(122)105-83(92)110-78(63)131)46(159-54)18-151-177(142,186)168-37-6-55(119-14-33(2)76(129)116-89(119)137)160-47(37)19-152-180(145,189)173-42-11-60(125-30-103-66-73(125)108-86(95)113-81(66)134)166-52(42)24-157-183(148,192)174-43-12-61(126-31-104-67-74(126)109-87(96)114-82(67)135)164-50(43)22-155-178(143,187)169-38-7-56(120-15-34(3)77(130)117-90(120)138)161-48(38)20-153-181(146,190)172-41-10-59(124-29-102-65-72(124)107-85(94)112-80(65)133)165-51(41)23-156-182(147,191)171-40-8-57(121-26-99-62-68(91)97-25-98-69(62)121)163-49(40)21-154-179(144,188)170-39-9-58(162-45(39)17-149-175(139,140)184)123-28-101-64-71(123)106-84(93)111-79(64)132/h13-15,25-31,35-61,127H,4-12,16-24H2,1-3H3,(H,141,185)(H,142,186)(H,143,187)(H,144,188)(H,145,189)(H,146,190)(H,147,191)(H,148,192)(H2,91,97,98)(H,115,128,136)(H,116,129,137)(H,117,130,138)(H2,139,140,184)(H3,92,105,110,131)(H3,93,106,111,132)(H3,94,107,112,133)(H3,95,108,113,134)(H3,96,109,114,135)

InChIKey

XDFXYMSOQJSVDE-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16204641