CID 16130794
T g t t a c g t t t g g t t t t t c t t (2'-o-methyl)
Structural Information
- Molecular Formula
- C218H295N57O153P20
- SMILES
- CC1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)(O)OC3C(OC(C3OC)N4C=C(C(=O)NC4=O)C)COP(=O)(O)OC5C(OC(C5OC)N6C=CC(=NC6=O)N)COP(=O)(O)OC7C(OC(C7OC)N8C=C(C(=O)NC8=O)C)COP(=O)(O)OC9C(OC(C9OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=CC(=NC1=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C(N=CN=C21)N)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)OC1C(OC(C1OC)N1C=NC2=C1N=C(NC2=O)N)COP(=O)(O)OC1C(OC(C1OC)N1C=C(C(=O)NC1=O)C)COP(=O)(O)O)O)OC
- InChI
- InChI=1S/C218H295N57O153P20/c1-77-38-258(206(296)243-163(77)277)180-137(350-14)117(276)90(390-180)51-371-430(312,313)413-121-94(394-184(141(121)354-18)260-40-79(3)165(279)245-208(260)298)55-374-432(316,317)411-119-92(391-181(138(119)351-15)256-36-34-110(219)233-204(256)294)53-372-434(320,321)414-122-95(395-185(142(122)355-19)261-41-80(4)166(280)246-209(261)299)56-375-435(322,323)415-123-96(396-186(143(123)356-20)262-42-81(5)167(281)247-210(262)300)57-376-436(324,325)416-124-97(397-187(144(124)357-21)263-43-82(6)168(282)248-211(263)301)58-377-437(326,327)417-125-98(398-188(145(125)358-22)264-44-83(7)169(283)249-212(264)302)59-378-440(332,333)420-128-104(404-191(148(128)361-25)267-47-86(10)172(286)252-215(267)305)65-384-447(346,347)427-135-109(409-198(155(135)368-32)274-75-231-115-161(274)237-202(224)241-178(115)292)70-389-448(348,349)428-136-108(408-199(156(136)369-33)275-76-232-116-162(275)238-203(225)242-179(116)293)69-388-443(338,339)423-131-101(401-194(151(131)364-28)270-50-89(13)175(289)255-218(270)308)62-381-438(328,329)418-126-99(399-189(146(126)359-23)265-45-84(8)170(284)250-213(265)303)60-379-439(330,331)419-127-103(403-190(147(127)360-24)266-46-85(9)171(285)251-214(266)304)64-383-446(344,345)426-134-107(407-197(154(134)367-31)273-74-230-114-160(273)236-201(223)240-177(114)291)68-387-433(318,319)412-120-93(392-182(139(120)352-16)257-37-35-111(220)234-205(257)295)54-373-444(340,341)424-132-105(405-195(152(132)365-29)271-72-228-112-157(221)226-71-227-158(112)271)66-385-442(336,337)422-130-100(400-193(150(130)363-27)269-49-88(12)174(288)254-217(269)307)61-380-441(334,335)421-129-102(402-192(149(129)362-26)268-48-87(11)173(287)253-216(268)306)63-382-445(342,343)425-133-106(406-196(153(133)366-30)272-73-229-113-159(272)235-200(222)239-176(113)290)67-386-431(314,315)410-118-91(52-370-429(309,310)311)393-183(140(118)353-17)259-39-78(2)164(278)244-207(259)297/h34-50,71-76,90-109,117-156,180-199,276H,51-70H2,1-33H3,(H,312,313)(H,314,315)(H,316,317)(H,318,319)(H,320,321)(H,322,323)(H,324,325)(H,326,327)(H,328,329)(H,330,331)(H,332,333)(H,334,335)(H,336,337)(H,338,339)(H,340,341)(H,342,343)(H,344,345)(H,346,347)(H,348,349)(H2,219,233,294)(H2,220,234,295)(H2,221,226,227)(H,243,277,296)(H,244,278,297)(H,245,279,298)(H,246,280,299)(H,247,281,300)(H,248,282,301)(H,249,283,302)(H,250,284,303)(H,251,285,304)(H,252,286,305)(H,253,287,306)(H,254,288,307)(H,255,289,308)(H2,309,310,311)(H3,222,235,239,290)(H3,223,236,240,291)(H3,224,237,241,292)(H3,225,238,242,293)
- InChIKey
- FZKLPGIZWQETGM-UHFFFAOYSA-N
- Compound name
- [5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[hydroxy-[[3-[hydroxy-[[3-hydroxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)-4-methoxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-methoxyoxolan-2-yl]methyl [4-methoxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6779.1880 | 311.5 |
[M+Na]+ | 6801.1699 | 311.5 |
[M-H]- | 6777.1734 | 311.5 |
[M+NH4]+ | 6796.2145 | 311.5 |
[M+K]+ | 6817.1439 | 311.5 |
[M+H-H2O]+ | 6761.1780 | 311.5 |
[M+HCOO]- | 6823.1789 | 311.5 |
[M+CH3COO]- | 6837.1946 | 311.5 |
[M+Na-2H]- | 6799.1554 | 311.5 |
[M]+ | 6778.1802 | 311.5 |
[M]- | 6778.1812 | 311.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.