CID 16130809
G-g-g-g-t-g-g-g-t-g-g-g-t-g-g-g-t-t-t
Structural Information
- Molecular Formula
- C200H248N82O127P20
- SMILES
- 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(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)OC1CC(OC1COP(=O)(O)O)N1C=NC2=C1N=C(NC2=O)N)N1C=NC2=C1N=C(NC2=O)N)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)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)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)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)O
- InChI
- InChI=1S/C200H248N82O127P20/c1-67-27-263(195(304)257-161(67)284)113-7-73(283)93(371-113)33-352-411(313,314)391-74-8-114(264-28-68(2)162(285)258-196(264)305)372-95(74)35-353-412(315,316)392-75-9-115(265-29-69(3)163(286)259-197(265)306)373-96(75)36-354-417(325,326)397-80-14-120(270-54-216-134-148(270)230-182(202)244-168(134)291)382-104(80)44-362-425(341,342)405-88-22-128(278-62-224-142-156(278)238-190(210)252-176(142)299)386-108(88)48-366-421(333,334)401-84-18-124(274-58-220-138-152(274)234-186(206)248-172(138)295)378-100(84)40-358-413(317,318)393-76-10-116(266-30-70(4)164(287)260-198(266)307)374-97(76)37-355-418(327,328)398-81-15-121(271-55-217-135-149(271)231-183(203)245-169(135)292)383-105(81)45-363-426(343,344)406-89-23-129(279-63-225-143-157(279)239-191(211)253-177(143)300)387-109(89)49-367-422(335,336)402-85-19-125(275-59-221-139-153(275)235-187(207)249-173(139)296)379-101(85)41-359-414(319,320)394-77-11-117(267-31-71(5)165(288)261-199(267)308)375-98(77)38-356-419(329,330)399-82-16-122(272-56-218-136-150(272)232-184(204)246-170(136)293)384-106(82)46-364-427(345,346)407-90-24-130(280-64-226-144-158(280)240-192(212)254-178(144)301)388-110(90)50-368-423(337,338)403-86-20-126(276-60-222-140-154(276)236-188(208)250-174(140)297)380-102(86)42-360-415(321,322)395-78-12-118(268-32-72(6)166(289)262-200(268)309)376-99(78)39-357-420(331,332)400-83-17-123(273-57-219-137-151(273)233-185(205)247-171(137)294)385-107(83)47-365-428(347,348)408-91-25-131(281-65-227-145-159(281)241-193(213)255-179(145)302)390-112(91)52-370-429(349,350)409-92-26-132(282-66-228-146-160(282)242-194(214)256-180(146)303)389-111(92)51-369-424(339,340)404-87-21-127(277-61-223-141-155(277)237-189(209)251-175(141)298)381-103(87)43-361-416(323,324)396-79-13-119(377-94(79)34-351-410(310,311)312)269-53-215-133-147(269)229-181(201)243-167(133)290/h27-32,53-66,73-132,283H,7-26,33-52H2,1-6H3,(H,313,314)(H,315,316)(H,317,318)(H,319,320)(H,321,322)(H,323,324)(H,325,326)(H,327,328)(H,329,330)(H,331,332)(H,333,334)(H,335,336)(H,337,338)(H,339,340)(H,341,342)(H,343,344)(H,345,346)(H,347,348)(H,349,350)(H,257,284,304)(H,258,285,305)(H,259,286,306)(H,260,287,307)(H,261,288,308)(H,262,289,309)(H2,310,311,312)(H3,201,229,243,290)(H3,202,230,244,291)(H3,203,231,245,292)(H3,204,232,246,293)(H3,205,233,247,294)(H3,206,234,248,295)(H3,207,235,249,296)(H3,208,236,250,297)(H3,209,237,251,298)(H3,210,238,252,299)(H3,211,239,253,300)(H3,212,240,254,301)(H3,213,241,255,302)(H3,214,242,256,303)
- InChIKey
- RMGONJAHTJBRJS-UHFFFAOYSA-N
- Compound name
- [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-[[[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-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-[[[5-(2-amino-6-oxo-1H-purin-9-yl)-2-(phosphonooxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]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]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] [3-[hydroxy-[[3-[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6450.0293 | 311.5 |
[M+Na]+ | 6472.0112 | 311.5 |
[M-H]- | 6448.0147 | 311.5 |
[M+NH4]+ | 6467.0558 | 311.5 |
[M+K]+ | 6487.9852 | 311.5 |
[M+H-H2O]+ | 6432.0193 | 311.5 |
[M+HCOO]- | 6494.0202 | 311.5 |
[M+CH3COO]- | 6508.0359 | 311.5 |
[M+Na-2H]- | 6469.9967 | 311.5 |
[M]+ | 6449.0215 | 311.5 |
[M]- | 6449.0225 | 311.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.