CID 16130790
G g t t t t t c t t t g a g g t t t a g
Structural Information
- Molecular Formula
- C199H253N65O130P20
- 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)O)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)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=C(C(=O)NC1=O)C)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)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=C(N=CN=C21)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=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O
- InChI
- InChI=1S/C199H253N65O130P20/c1-75-34-246(189(284)234-165(75)266)129-16-88(110(359-129)49-340-400(306,307)379-90-18-131(248-36-77(3)167(268)236-191(248)286)361-112(90)51-342-401(308,309)380-91-19-132(249-37-78(4)168(269)237-192(249)287)362-113(91)52-343-402(310,311)381-92-20-133(250-38-79(5)169(270)238-193(250)288)363-114(92)53-344-405(316,317)384-95-23-136(253-41-82(8)172(273)241-196(253)291)367-118(95)57-348-410(326,327)391-102-30-143(261-71-217-151-161(261)224-184(205)230-178(151)279)373-123(102)62-353-409(324,325)388-99-29-142(369-107(99)46-336-395(295,296)297)260-70-216-150-160(260)223-183(204)229-177(150)278)377-398(302,303)338-47-108-87(15-128(357-108)245-13-12-126(200)221-188(245)283)376-397(300,301)339-48-109-89(17-130(358-109)247-35-76(2)166(267)235-190(247)285)378-399(304,305)341-50-111-93(21-134(360-111)251-39-80(6)170(271)239-194(251)289)383-404(314,315)347-56-117-98(26-139(366-117)256-44-85(11)175(276)244-199(256)294)387-408(322,323)352-61-122-104(32-145(372-122)263-73-219-153-163(263)226-186(207)232-180(153)281)393-413(332,333)351-60-121-101(28-141(371-121)258-68-214-148-156(202)210-66-212-158(148)258)390-412(330,331)354-63-124-105(33-146(374-124)264-74-220-154-164(264)227-187(208)233-181(154)282)394-414(334,335)355-64-125-103(31-144(375-125)262-72-218-152-162(262)225-185(206)231-179(152)280)392-411(328,329)349-58-119-96(24-137(368-119)254-42-83(9)173(274)242-197(254)292)385-406(318,319)345-54-115-94(22-135(364-115)252-40-81(7)171(272)240-195(252)290)382-403(312,313)346-55-116-97(25-138(365-116)255-43-84(10)174(275)243-198(255)293)386-407(320,321)350-59-120-100(27-140(370-120)257-67-213-147-155(201)209-65-211-157(147)257)389-396(298,299)337-45-106-86(265)14-127(356-106)259-69-215-149-159(259)222-182(203)228-176(149)277/h12-13,34-44,65-74,86-125,127-146,265H,14-33,45-64H2,1-11H3,(H,298,299)(H,300,301)(H,302,303)(H,304,305)(H,306,307)(H,308,309)(H,310,311)(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)(H2,200,221,283)(H2,201,209,211)(H2,202,210,212)(H,234,266,284)(H,235,267,285)(H,236,268,286)(H,237,269,287)(H,238,270,288)(H,239,271,289)(H,240,272,290)(H,241,273,291)(H,242,274,292)(H,243,275,293)(H,244,276,294)(H2,295,296,297)(H3,203,222,228,277)(H3,204,223,229,278)(H3,205,224,230,279)(H3,206,225,231,280)(H3,207,226,232,281)(H3,208,227,233,282)
- InChIKey
- WYUUYUPBOFIYQE-UHFFFAOYSA-N
- Compound name
- [5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-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-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methyl [5-(2-amino-6-oxo-1H-purin-9-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]+ | 6253.0010 | 311.5 |
[M+Na]+ | 6274.9829 | 311.5 |
[M-H]- | 6250.9864 | 311.5 |
[M+NH4]+ | 6270.0275 | 311.5 |
[M+K]+ | 6290.9569 | 311.5 |
[M+H-H2O]+ | 6234.9910 | 311.5 |
[M+HCOO]- | 6296.9919 | 311.5 |
[M+CH3COO]- | 6311.0076 | 311.5 |
[M+Na-2H]- | 6272.9684 | 311.5 |
[M]+ | 6251.9932 | 311.5 |
[M]- | 6251.9942 | 311.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.