5'-d(gsggt'gggtgggtgggst)-3'

Structural Information

Molecular Formula

C₁₆₂H₁₉₇N₆₈O₉₆P₁₅S₂

SMILES

CC#CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OC3CC(OC3COP(=O)(O)OC4CC(OC4COP(=S)(O)OC5CC(OC5CO)N6C=NC7=C6N=C(NC7=O)N)N8C=NC9=C8N=C(NC9=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(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)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(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)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/C162H197N68O96P15S2/c1-5-6-58-26-218(162(252)214-134(58)236)94-11-63(79(300-94)31-283-332(263,264)317-66-14-98(222-46-178-110-122(222)190-150(166)202-138(110)240)309-88(66)40-292-338(275,276)324-73-21-105(229-53-185-117-129(229)197-157(173)209-145(117)247)311-90(73)42-295-341(280,343)325-60-8-95(296-75(60)27-231)219-43-175-107-119(219)187-147(163)199-135(107)237)314-329(257,258)286-34-82-69(17-101(303-82)225-49-181-113-125(225)193-153(169)205-141(113)243)320-334(267,268)290-38-86-71(19-103(307-86)227-51-183-115-127(227)195-155(171)207-143(115)245)322-336(271,272)288-36-84-65(13-97(305-84)221-45-177-109-121(221)189-149(165)201-137(109)239)316-330(259,260)281-29-77-61(9-92(298-77)216-24-56(3)132(234)212-160(216)250)312-327(253,254)284-32-80-67(15-99(301-80)223-47-179-111-123(223)191-151(167)203-139(111)241)318-333(265,266)289-37-85-70(18-102(306-85)226-50-182-114-126(226)194-154(170)206-142(114)244)321-335(269,270)287-35-83-64(12-96(304-83)220-44-176-108-120(220)188-148(164)200-136(108)238)315-331(261,262)282-30-78-62(10-93(299-78)217-25-57(4)133(235)213-161(217)251)313-328(255,256)285-33-81-68(16-100(302-81)224-48-180-112-124(224)192-152(168)204-140(112)242)319-337(273,274)291-39-87-72(20-104(308-87)228-52-184-116-128(228)196-156(172)208-144(116)246)323-339(277,278)293-41-89-74(22-106(310-89)230-54-186-118-130(230)198-158(174)210-146(118)248)326-340(279,342)294-28-76-59(232)7-91(297-76)215-23-55(2)131(233)211-159(215)249/h23-26,43-54,59-106,231-232H,7-22,27-42H2,1-4H3,(H,253,254)(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,279,342)(H,280,343)(H,211,233,249)(H,212,234,250)(H,213,235,251)(H,214,236,252)(H3,163,187,199,237)(H3,164,188,200,238)(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)

InChIKey

HXXNESLMDGWZCR-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-(5-methyl-2,4-dioxopyrimidin-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 16134096