CID 16186591
5'-dbb-d[tggggg]-3'
Structural Information
- Molecular Formula
- C81H92N27O37P5
- SMILES
- CC1=CN(C(=O)NC1=O)C2CC(C(O2)COCC3=CC(=C(C=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)OP(=O)(O)OCC6C(CC(O6)N7C=NC8=C7N=C(NC8=O)N)OP(=O)(O)OCC9C(CC(O9)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=NC2=C1N=C(NC2=O)N)OP(=O)(O)OCC1C(CC(O1)N1C=NC2=C1N=C(NC2=O)N)O
- InChI
- InChI=1S/C81H92N27O37P5/c1-36-21-103(81(116)102-70(36)110)55-16-43(49(136-55)25-127-22-39-12-13-41(128-23-37-8-4-2-5-9-37)42(14-39)129-24-38-10-6-3-7-11-38)141-147(119,120)131-27-51-45(18-57(138-51)106-33-89-62-67(106)94-78(84)99-73(62)113)143-149(123,124)133-29-53-47(20-59(140-53)108-35-91-64-69(108)96-80(86)101-75(64)115)145-150(125,126)134-30-52-46(19-58(139-52)107-34-90-63-68(107)95-79(85)100-74(63)114)144-148(121,122)132-28-50-44(17-56(137-50)105-32-88-61-66(105)93-77(83)98-72(61)112)142-146(117,118)130-26-48-40(109)15-54(135-48)104-31-87-60-65(104)92-76(82)97-71(60)111/h2-14,21,31-35,40,43-59,109H,15-20,22-30H2,1H3,(H,117,118)(H,119,120)(H,121,122)(H,123,124)(H,125,126)(H,102,110,116)(H3,82,92,97,111)(H3,83,93,98,112)(H3,84,94,99,113)(H3,85,95,100,114)(H3,86,96,101,115)
- InChIKey
- WAOZWKKWLLBFOH-UHFFFAOYSA-N
- Compound name
- [5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-[[5-(2-amino-6-oxo-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyoxolan-2-yl]methyl [2-[[3,4-bis(phenylmethoxy)phenyl]methoxymethyl]-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] hydrogen phosphate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 2190.4909 | 232.3 |
[M+Na]+ | 2212.4728 | 243.0 |
[M-H]- | 2188.4763 | 232.1 |
[M+NH4]+ | 2207.5174 | 236.1 |
[M+K]+ | 2228.4468 | 239.9 |
[M+H-H2O]+ | 2172.4809 | 231.0 |
[M+HCOO]- | 2234.4818 | 237.1 |
[M+CH3COO]- | 2248.4975 | 239.0 |
[M+Na-2H]- | 2210.4583 | 241.0 |
[M]+ | 2189.4831 | 243.0 |
[M]- | 2189.4841 | 243.0 |
Literature stripe
Patent stripe
No patent data available for this compound.