Isis 9651

Structural Information

Molecular Formula

C₁₉₃H₂₄₇N₆₈O₁₀₃P₁₉S₁₉

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(=S)(O)OC8CC(OC8COP(=S)(O)OC9CC(OC9COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=O)(OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1COP(=S)(O)OC1CC(OC1CO)N1C=NC2=C(N=CN=C21)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=CC(=NC1=O)N)N1C=NC2=C1N=C(NC2=O)N)S)N1C=C(C(=O)NC1=O)C)N1C=NC2=C1N=C(NC2=O)N)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)N1C=NC2=C(N=CN=C21)N)N1C=C(C(=O)NC1=O)C)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)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)O

InChI

InChI=1S/C193H247N68O103P19S19/c1-76-41-249(188(282)236-165(76)264)129-21-82(263)103(327-129)48-307-365(288,384)347-84-23-130(242-14-7-122(194)219-181(242)275)329-105(84)50-311-373(296,392)354-91-30-137(250-42-77(2)166(265)237-189(250)283)335-111(91)56-315-375(298,394)356-93-32-139(252-44-79(4)168(267)239-191(252)285)338-114(93)59-318-381(304,400)362-99-38-146(259-73-216-153-162(259)228-178(205)233-173(153)272)343-119(99)64-323-372(295,391)353-90-29-136(248-20-13-128(200)225-187(248)281)334-110(90)55-314-379(302,398)361-98-37-145(258-72-215-152-161(258)227-177(204)232-172(152)271)344-120(98)65-324-376(299,395)357-94-33-140(253-45-80(5)169(268)240-192(253)286)336-112(94)57-316-380(303,399)359-96-35-143(256-70-213-150-157(202)209-68-211-159(150)256)340-116(96)61-320-369(292,388)351-89-28-135(247-19-12-127(199)224-186(247)280)332-108(89)53-312-374(297,393)355-92-31-138(251-43-78(3)167(266)238-190(251)284)337-113(92)58-317-383(306,402)364-101-40-148(261-75-218-155-164(261)230-180(207)235-175(155)274)345-121(101)66-325-377(300,396)358-95-34-141(254-46-81(6)170(269)241-193(254)287)339-115(95)60-319-382(305,401)363-100-39-147(260-74-217-154-163(260)229-179(206)234-174(154)273)342-118(100)63-322-371(294,390)352-88-27-134(246-18-11-126(198)223-185(246)279)331-107(88)52-310-367(290,386)348-86-25-132(244-16-9-124(196)221-183(244)277)330-106(86)51-309-368(291,387)349-87-26-133(245-17-10-125(197)222-184(245)278)333-109(87)54-313-378(301,397)360-97-36-144(257-71-214-151-160(257)226-176(203)231-171(151)270)341-117(97)62-321-370(293,389)350-85-24-131(243-15-8-123(195)220-182(243)276)328-104(85)49-308-366(289,385)346-83-22-142(326-102(83)47-262)255-69-212-149-156(201)208-67-210-158(149)255/h7-20,41-46,67-75,82-121,129-148,262-263H,21-40,47-66H2,1-6H3,(H,288,384)(H,289,385)(H,290,386)(H,291,387)(H,292,388)(H,293,389)(H,294,390)(H,295,391)(H,296,392)(H,297,393)(H,298,394)(H,299,395)(H,300,396)(H,301,397)(H,302,398)(H,303,399)(H,304,400)(H,305,401)(H,306,402)(H2,194,219,275)(H2,195,220,276)(H2,196,221,277)(H2,197,222,278)(H2,198,223,279)(H2,199,224,280)(H2,200,225,281)(H2,201,208,210)(H2,202,209,211)(H,236,264,282)(H,237,265,283)(H,238,266,284)(H,239,267,285)(H,240,268,286)(H,241,269,287)(H3,203,226,231,270)(H3,204,227,232,271)(H3,205,228,233,272)(H3,206,229,234,273)(H3,207,230,235,274)

InChIKey

WFEOPBKKQZWCLJ-UHFFFAOYSA-N

Compound name

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

Related CIDs

• CID 16204709