5'-gggcgttgggcg-3'

Structural Information

Molecular Formula

C₁₁₈H₁₄₈N₅₀O₆₃P₁₂S₁₂

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(=O)(OC7CC(OC7COP(=S)(O)OC8CC(OC8COP(=S)(O)O)N9C=NC1=C9N=C(NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)S)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=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)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(=S)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O

InChI

InChI=1S/C118H148N50O63P12S12/c1-41-19-159(117(182)155-97(41)170)72-10-46(60(213-72)26-202-240(193,252)228-51-15-77(165-37-133-85-93(165)143-111(125)151-103(85)176)215-61(51)27-203-234(187,246)222-45-9-71(158-6-4-68(120)138-116(158)181)211-58(45)24-200-239(192,251)227-50-14-76(164-36-132-84-92(164)142-110(124)150-102(84)175)219-65(50)31-206-242(195,254)230-53-17-79(167-39-135-87-95(167)145-113(127)153-105(87)178)217-63(53)29-205-237(190,249)225-48-12-74(214-56(48)22-197-232(184,185)244)162-34-130-82-90(162)140-108(122)148-100(82)173)223-235(188,247)201-25-59-47(11-73(212-59)160-20-42(2)98(171)156-118(160)183)224-236(189,248)204-28-62-52(16-78(216-62)166-38-134-86-94(166)144-112(126)152-104(86)177)229-241(194,253)208-32-66-54(18-80(220-66)168-40-136-88-96(168)146-114(128)154-106(88)179)231-243(196,255)207-30-64-49(13-75(218-64)163-35-131-83-91(163)141-109(123)149-101(83)174)226-238(191,250)199-23-57-44(8-70(210-57)157-5-3-67(119)137-115(157)180)221-233(186,245)198-21-55-43(169)7-69(209-55)161-33-129-81-89(161)139-107(121)147-99(81)172/h3-6,19-20,33-40,43-66,69-80,169H,7-18,21-32H2,1-2H3,(H,186,245)(H,187,246)(H,188,247)(H,189,248)(H,190,249)(H,191,250)(H,192,251)(H,193,252)(H,194,253)(H,195,254)(H,196,255)(H2,119,137,180)(H2,120,138,181)(H,155,170,182)(H,156,171,183)(H2,184,185,244)(H3,121,139,147,172)(H3,122,140,148,173)(H3,123,141,149,174)(H3,124,142,150,175)(H3,125,143,151,176)(H3,126,144,152,177)(H3,127,145,153,178)(H3,128,146,154,179)

InChIKey

MIRUZEWHUCBLMU-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16204662