5'-tagtgggcg-3'

Structural Information

Molecular Formula

C₈₉H₁₁₂N₃₇O₄₇P₉S₉

SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)O)OP(=S)(O)OCC3C(CC(O3)N4C=NC5=C(N=CN=C54)N)OP(=S)(O)OCC6C(CC(O6)N7C=NC8=C7N=C(NC8=O)N)OP(=S)(O)OCC9C(CC(O9)N1C=C(C(=O)NC1=O)C)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=C1N=C(NC2=O)N)O)S

InChI

InChI=1S/C89H112N37O47P9S9/c1-32-14-119(88(136)116-75(32)128)55-7-36(44(159-55)17-148-174(138,139)183)167-176(141,185)152-20-47-38(9-57(161-47)121-26-99-62-68(91)97-25-98-69(62)121)169-180(145,189)154-22-49-40(11-59(163-49)124-29-102-65-72(124)108-84(94)113-79(65)132)171-179(144,188)151-19-46-37(8-56(160-46)120-15-33(2)76(129)117-89(120)137)168-177(142,186)153-21-48-41(12-60(162-48)125-30-103-66-73(125)109-85(95)114-80(66)133)172-181(146,190)156-24-51-42(13-61(165-51)126-31-104-67-74(126)110-86(96)115-81(67)134)173-182(147,191)155-23-50-39(10-58(164-50)123-28-101-64-71(123)107-83(93)112-78(64)131)170-178(143,187)150-18-45-35(6-54(158-45)118-4-3-52(90)105-87(118)135)166-175(140,184)149-16-43-34(127)5-53(157-43)122-27-100-63-70(122)106-82(92)111-77(63)130/h3-4,14-15,25-31,34-51,53-61,127H,5-13,16-24H2,1-2H3,(H,140,184)(H,141,185)(H,142,186)(H,143,187)(H,144,188)(H,145,189)(H,146,190)(H,147,191)(H2,90,105,135)(H2,91,97,98)(H,116,128,136)(H,117,129,137)(H2,138,139,183)(H3,92,106,111,130)(H3,93,107,112,131)(H3,94,108,113,132)(H3,95,109,114,133)(H3,96,110,115,134)

InChIKey

JWZNCAIFQCYTGI-UHFFFAOYSA-N

Compound name

1-[4-[[3-[[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-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-sulfanylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-5-(dihydroxyphosphinothioyloxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Related CIDs

• CID 16204660