5'-d(gsggt'gggtgggt'gggst)-3'

Structural Information

Molecular Formula

C₁₆₄H₁₉₇N₆₈O₉₆P₁₅S₂

SMILES

CC#CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=O)(O)OC5CC(OC5COP(=O)(O)OC6CC(OC6COP(=O)(O)OC7CC(OC7COP(=O)(O)OC8CC(OC8COP(=O)(O)OC9CC(OC9COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1CO)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C#CC)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)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=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=S)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)O

InChI

InChI=1S/C164H197N68O96P15S2/c1-5-7-59-27-219(163(253)215-135(59)237)95-12-64(315-331(259,260)288-36-84-71(19-103(305-84)227-51-183-115-127(227)195-155(171)207-143(115)245)322-339(275,276)293-41-89-74(22-106(310-89)230-54-186-118-130(230)198-158(174)210-146(118)248)325-341(279,280)295-43-91-76(24-108(312-91)232-56-188-120-132(232)200-160(176)212-148(120)250)328-342(281,344)296-30-78-61(234)9-93(299-78)217-25-57(3)133(235)213-161(217)251)80(301-95)32-284-333(263,264)318-67-15-99(223-47-179-111-123(223)191-151(167)203-139(111)241)307-86(67)38-290-338(273,274)324-73-21-105(229-53-185-117-129(229)197-157(173)209-145(117)247)308-87(73)39-291-335(267,268)320-69-17-101(225-49-181-113-125(225)193-153(169)205-141(113)243)303-82(69)34-286-329(255,256)314-63-11-94(218-26-58(4)134(236)214-162(218)252)300-79(63)31-283-332(261,262)317-66-14-98(222-46-178-110-122(222)190-150(166)202-138(110)240)306-85(66)37-289-337(271,272)323-72-20-104(228-52-184-116-128(228)196-156(172)208-144(116)246)309-88(72)40-292-336(269,270)321-70-18-102(226-50-182-114-126(226)194-154(170)206-142(114)244)304-83(70)35-287-330(257,258)316-65-13-96(220-28-60(8-6-2)136(238)216-164(220)254)302-81(65)33-285-334(265,266)319-68-16-100(224-48-180-112-124(224)192-152(168)204-140(112)242)311-90(68)42-294-340(277,278)326-75-23-107(231-55-187-119-131(231)199-159(175)211-147(119)249)313-92(75)44-297-343(282,345)327-62-10-97(298-77(62)29-233)221-45-177-109-121(221)189-149(165)201-137(109)239/h25-28,45-56,61-108,233-234H,9-24,29-44H2,1-4H3,(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,263,264)(H,265,266)(H,267,268)(H,269,270)(H,271,272)(H,273,274)(H,275,276)(H,277,278)(H,279,280)(H,281,344)(H,282,345)(H,213,235,251)(H,214,236,252)(H,215,237,253)(H,216,238,254)(H3,165,189,201,239)(H3,166,190,202,240)(H3,167,191,203,241)(H3,168,192,204,242)(H3,169,193,205,243)(H3,170,194,206,244)(H3,171,195,207,245)(H3,172,196,208,246)(H3,173,197,209,247)(H3,174,198,210,248)(H3,175,199,211,249)(H3,176,200,212,250)

InChIKey

ONUXHQSJBKPKQK-UHFFFAOYSA-N

Compound name

[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-[[[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-[[[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-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphinothioyl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2,4-dioxo-5-prop-1-ynylpyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]-5-(2,4-dioxo-5-prop-1-ynylpyrimidin-1-yl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(2-amino-6-oxo-1H-purin-9-yl)-3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphinothioyl]oxyoxolan-2-yl]methyl hydrogen phosphate

Related CIDs

• CID 16134100