CID 16197367
Cgtactcaccagtcg
Structural Information
- Molecular Formula
- C207H270N78O115P20
- SMILES
- CCCCCCCCCCOP(=O)(O)OCC1C(CC(O1)N2C=CC(=NC2=O)N)OP(=O)(O)OCC3C(CC(O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)OCC6C(CC(O6)N7C=CC(=NC7=O)N)OP(=O)(O)OCC8C(CC(O8)N9C=CC(=NC9=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)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=CC(=NC1=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=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)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)(C)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C(N=CN=C21)N)O
- InChI
- InChI=1S/C207H270N78O115P20/c1-8-9-10-11-12-13-14-15-26-341-403(305,306)344-53-117-97(30-140(363-117)266-21-16-134(208)251-199(266)294)384-408(315,316)354-63-126-106(39-149(374-126)276-80-241-160-171(214)225-72-233-179(160)276)393-413(325,326)349-58-121-99(32-142(367-121)268-23-18-136(210)253-201(268)296)386-406(311,312)346-55-118-98(31-141(364-118)267-22-17-135(209)252-200(267)295)385-405(309,310)347-56-119-101(34-144(365-119)270-25-20-138(212)255-203(270)298)388-409(317,318)355-64-127-109(42-152(375-127)279-83-244-163-174(217)228-75-236-182(163)279)396-416(331,332)356-65-128-108(41-151(376-128)278-82-243-162-173(216)227-74-235-181(162)278)395-415(329,330)353-62-125-104(37-147(371-125)273-49-92(4)191(289)264-206(273)301)391-411(321,322)351-60-123-103(36-146(369-123)272-48-91(3)190(288)263-205(272)300)390-410(319,320)348-57-120-100(33-143(366-120)269-24-19-137(211)254-202(269)297)387-407(313,314)350-59-122-105(38-148(368-122)274-50-93(5)192(290)265-207(274)302)392-412(323,324)361-70-133-113(46-158(381-133)285-89-250-169-188(285)258-198(223)261-195(169)293)400-420(339,340)360-69-132-112(45-155(380-132)282-86-247-166-177(220)231-78-239-185(166)282)399-419(337,338)359-68-131-111(44-154(379-131)281-85-246-165-176(219)230-77-238-184(165)281)398-418(335,336)358-67-130-110(43-153(378-130)280-84-245-164-175(218)229-76-237-183(164)280)397-417(333,334)357-66-129-107(40-150(377-129)277-81-242-161-172(215)226-73-234-180(161)277)394-414(327,328)352-61-124-102(35-145(370-124)271-47-90(2)189(287)262-204(271)299)389-404(307,308)345-54-116-96(29-157(373-116)284-88-249-168-187(284)257-197(222)260-194(168)292)383-402(7,304)343-52-115-95(28-156(372-115)283-87-248-167-186(283)256-196(221)259-193(167)291)382-401(6,303)342-51-114-94(286)27-139(362-114)275-79-240-159-170(213)224-71-232-178(159)275/h16-25,47-50,71-89,94-133,139-158,286H,8-15,26-46,51-70H2,1-7H3,(H,305,306)(H,307,308)(H,309,310)(H,311,312)(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)(H2,208,251,294)(H2,209,252,295)(H2,210,253,296)(H2,211,254,297)(H2,212,255,298)(H2,213,224,232)(H2,214,225,233)(H2,215,226,234)(H2,216,227,235)(H2,217,228,236)(H2,218,229,237)(H2,219,230,238)(H2,220,231,239)(H,262,287,299)(H,263,288,300)(H,264,289,301)(H,265,290,302)(H3,221,256,259,291)(H3,222,257,260,292)(H3,223,258,261,293)
- InChIKey
- YNAKSAASFNTNBZ-UHFFFAOYSA-N
- Compound name
- [3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-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-(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-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methyl decyl hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 6308.2503 | 311.5 |
[M+Na]+ | 6330.2322 | 311.5 |
[M-H]- | 6306.2357 | 311.5 |
[M+NH4]+ | 6325.2768 | 311.5 |
[M+K]+ | 6346.2062 | 311.5 |
[M+H-H2O]+ | 6290.2403 | 311.5 |
[M+HCOO]- | 6352.2412 | 311.5 |
[M+CH3COO]- | 6366.2569 | 311.5 |
[M+Na-2H]- | 6328.2177 | 311.5 |
[M]+ | 6307.2425 | 311.5 |
[M]- | 6307.2435 | 311.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.