| SpectraBase Compound ID | LOEpbdfFgAp |
|---|---|
| InChI | InChI=1S/C41H44N5O12P/c1-25-21-45(39(50)43-37(25)48)35-19-31(55-27(3)47)34(57-35)24-54-59(42,52)58-32-20-36(46-22-26(2)38(49)44-40(46)51)56-33(32)23-53-41(28-13-7-4-8-14-28,29-15-9-5-10-16-29)30-17-11-6-12-18-30/h4-18,21-22,31-36H,19-20,23-24H2,1-3H3,(H2,42,52)(H,43,48,50)(H,44,49,51)/t31-,32-,33+,34+,35+,36+,59?/m0/s1 |
| InChIKey | GAMQQPPKXAKFCS-XUOKHZHSSA-N |
| Mol Weight | 829.8 g/mol |
| Molecular Formula | C41H44N5O12P |
| Exact Mass | 829.272409 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1VC69q5tFdI |
|---|---|
| Name | 3'-O-ACETYL-5'-(5'-O-TRITYLDEOXYTHYMID-3'-YLOXY(AMIDO)PHOSPHORYL)DEOXYTHYMIDINE (DIASTEREOMER MIXTURE) |
| Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C41H44N5O12P |
| InChI | InChI=1S/C41H44N5O12P/c1-25-21-45(39(50)43-37(25)48)35-19-31(55-27(3)47)34(57-35)24-54-59(42,52)58-32-20-36(46-22-26(2)38(49)44-40(46)51)56-33(32)23-53-41(28-13-7-4-8-14-28,29-15-9-5-10-16-29)30-17-11-6-12-18-30/h4-18,21-22,31-36H,19-20,23-24H2,1-3H3,(H2,42,52)(H,43,48,50)(H,44,49,51)/t31-,32-,33+,34+,35+,36+,59?/m0/s1 |
| InChIKey | GAMQQPPKXAKFCS-XUOKHZHSSA-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 |