| SpectraBase Compound ID | LtUwu5VbzxI |
|---|---|
| InChI | InChI=1S/C36H40N6O18P2/c1-20(43)57-25-16-31(41-14-12-29(39-35(41)46)37-33(44)21-4-8-23(53-2)9-5-21)58-27(25)19-56-62(51,52)60-26-17-32(59-28(26)18-55-61(48,49)50)42-15-13-30(40-36(42)47)38-34(45)22-6-10-24(54-3)11-7-22/h4-15,25-28,31-32H,16-19H2,1-3H3,(H,51,52)(H2,48,49,50)(H,37,39,44,46)(H,38,40,45,47)/t25-,26-,27+,28+,31+,32+/m0/s1 |
| InChIKey | URJMYBZMUJSXLJ-SJGMKDMWSA-N |
| Mol Weight | 906.7 g/mol |
| Molecular Formula | C36H40N6O18P2 |
| Exact Mass | 906.187432 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 75DbIlebkSW |
|---|---|
| Name | 5'-(N-ANISOYL-5'-PHOSPHATOYLDEOXYCYTIDIN-3'-YLOXYPHOSPHORYL)-N-ANISOYL-3'-O-ACETYLDEOXYCYTIDINE |
| Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C36H40N6O18P2 |
| InChI | InChI=1S/C36H40N6O18P2/c1-20(43)57-25-16-31(41-14-12-29(39-35(41)46)37-33(44)21-4-8-23(53-2)9-5-21)58-27(25)19-56-62(51,52)60-26-17-32(59-28(26)18-55-61(48,49)50)42-15-13-30(40-36(42)47)38-34(45)22-6-10-24(54-3)11-7-22/h4-15,25-28,31-32H,16-19H2,1-3H3,(H,51,52)(H2,48,49,50)(H,37,39,44,46)(H,38,40,45,47)/t25-,26-,27+,28+,31+,32+/m0/s1 |
| InChIKey | URJMYBZMUJSXLJ-SJGMKDMWSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | A.V.LEBEDEV, A.I.REZVUKHIN (REVIEW) (1983) Bioorganich.Khim.(Russ. Lang.): v.9,N2, 149-185. |
| NMR Standard | -H3PO4 85% |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C5H5N pyridine |