CID 16197473
5'tcgtcgctgtctcc-3'
Structural Information
- Molecular Formula
- C148H203N43O76P14
- SMILES
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(C)O)OP(=O)(C)OCC3C(CC(O3)N4C=CC(=NC4=O)N)OP(=O)(C)OCC5C(CC(O5)N6C=NC7=C6N=C(NC7=O)N)OP(=O)(C)OCC8C(CC(O8)N9C=C(C(=O)NC9=O)C)OP(=O)(C)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(C)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(C)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=C(C(=O)NC1=O)C)OP(=O)(C)OCC1C(CC(O1)N1C=CC(=NC1=O)N)OP(=O)(C)OCC1C(CC(O1)N1C=CC(=NC1=O)N)O
- InChI
- InChI=1S/C148H203N43O76P14/c1-68-46-184(144(207)173-127(68)193)113-38-79(88(247-113)52-227-268(6,212)213)260-274(12,219)229-54-90-77(36-111(243-90)182-30-24-105(153)165-142(182)205)258-272(10,217)239-63-99-85(44-119(253-99)190-66-159-122-125(190)168-136(156)171-133(122)199)266-280(18,225)236-60-96-82(41-116(250-96)187-49-71(4)130(196)176-147(187)210)263-277(15,222)232-56-92-78(37-112(245-92)183-31-25-106(154)166-143(183)206)259-273(11,218)238-62-98-84(43-118(252-98)189-65-158-121-124(189)167-135(155)170-132(121)198)265-279(17,224)233-57-93-76(35-110(246-93)181-29-23-104(152)164-141(181)204)257-271(9,216)235-59-95-83(42-117(249-95)188-50-72(5)131(197)177-148(188)211)264-278(16,223)240-64-100-86(45-120(254-100)191-67-160-123-126(191)169-137(157)172-134(123)200)267-281(19,226)237-61-97-81(40-115(251-97)186-48-70(3)129(195)175-146(186)209)262-276(14,221)231-55-91-75(34-109(244-91)180-28-22-103(151)163-140(180)203)256-270(8,215)234-58-94-80(39-114(248-94)185-47-69(2)128(194)174-145(185)208)261-275(13,220)230-53-89-74(33-108(242-89)179-27-21-102(150)162-139(179)202)255-269(7,214)228-51-87-73(192)32-107(241-87)178-26-20-101(149)161-138(178)201/h20-31,46-50,65-67,73-100,107-120,192H,32-45,51-64H2,1-19H3,(H,212,213)(H2,149,161,201)(H2,150,162,202)(H2,151,163,203)(H2,152,164,204)(H2,153,165,205)(H2,154,166,206)(H,173,193,207)(H,174,194,208)(H,175,195,209)(H,176,196,210)(H,177,197,211)(H3,155,167,170,198)(H3,156,168,171,199)(H3,157,169,172,200)
- InChIKey
- SMDDBJFTOBZDDK-UHFFFAOYSA-N
- Compound name
- [3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-[[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxyoxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(4-amino-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphoryl]oxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methylphosphinic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 4232.9743 | 307.4 |
[M+Na]+ | 4254.9562 | 308.3 |
[M-H]- | 4230.9597 | 307.7 |
[M+NH4]+ | 4250.0008 | 307.7 |
[M+K]+ | 4270.9302 | 307.7 |
[M+H-H2O]+ | 4214.9643 | 307.2 |
[M+HCOO]- | 4276.9652 | 307.8 |
[M+CH3COO]- | 4290.9809 | 307.9 |
[M+Na-2H]- | 4252.9417 | 309.4 |
[M]+ | 4231.9665 | 307.9 |
[M]- | 4231.9675 | 307.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.