| SpectraBase Compound ID | LBWGttXXej7 |
|---|---|
| InChI | InChI=1S/C27H36N6O15P2/c1-15-11-32(26(37)28-24(15)35)22-9-18(34)20(45-22)13-43-49(39,40)47-19-10-23(33-12-16(2)25(36)29-27(33)38)46-21(19)14-44-50(41,42)48-31-7-5-17(6-8-31)30(3)4/h5-8,11-12,18-23,34H,9-10,13-14H2,1-4H3,(H3-,28,29,35,36,37,38,39,40,41,42)/t18-,19-,20+,21+,22+,23+/m0/s1 |
| InChIKey | MYSRJACDAWUMBS-ZFPSYYEBSA-N |
| Mol Weight | 746.6 g/mol |
| Molecular Formula | C27H36N6O15P2 |
| Exact Mass | 746.171388 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GyPdwrHomd6 |
|---|---|
| Name | DITHYMIDINE DIPHOSPHATE, 4-DIMETHYLAMINOPYRIDINE-1-OXIDE DERIVATIVE |
| Comments | , NAME DEFINED, TERMINAL PO4 GROUP MAY BE CONNECTED TO ATOM C5 OF OTHER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C27H36N6O15P2 |
| InChI | InChI=1S/C27H36N6O15P2/c1-15-11-32(26(37)28-24(15)35)22-9-18(34)20(45-22)13-43-49(39,40)47-19-10-23(33-12-16(2)25(36)29-27(33)38)46-21(19)14-44-50(41,42)48-31-7-5-17(6-8-31)30(3)4/h5-8,11-12,18-23,34H,9-10,13-14H2,1-4H3,(H3-,28,29,35,36,37,38,39,40,41,42)/t18-,19-,20+,21+,22+,23+/m0/s1 |
| InChIKey | MYSRJACDAWUMBS-ZFPSYYEBSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | T.S.GODOVIKOVA, V.F.ZARYTOVA, T.V.MAL'TSEVA, L.M.KHALIMSKAYA (1989)Bioorganich.Khim.(Russ. Lang.): v.15, N9, 1246-1252. |
| NMR Standard | not reported |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C3H7NO dimethylforma |