| SpectraBase Compound ID | 4G1mhgQplM3 |
|---|---|
| InChI | InChI=1S/C20H28N4O15P2/c1-9-5-23(19(28)21-17(9)26)15-3-11(25)13(37-15)7-36-41(33,34)39-12-4-16(38-14(12)8-35-40(30,31)32)24-6-10(2)18(27)22-20(24)29/h5-6,11-16,25H,3-4,7-8H2,1-2H3,(H,33,34)(H,21,26,28)(H,22,27,29)(H2,30,31,32)/t11-,12-,13+,14+,15+,16+/m0/s1 |
| InChIKey | MMXKIWIWQPKTIK-KPRKPIBOSA-N |
| Mol Weight | 626.4 g/mol |
| Molecular Formula | C20H28N4O15P2 |
| Exact Mass | 626.10264 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FLHIWl3IHns |
|---|---|
| Name | DITHYMIDINE DIPHOSPHATE |
| Comments | , NAME DEFINED, TERMINAL PO4 GROUP MAY BE CONNECTED TO ATOM C5 OF OTHER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H28N4O15P2 |
| InChI | InChI=1S/C20H28N4O15P2/c1-9-5-23(19(28)21-17(9)26)15-3-11(25)13(37-15)7-36-41(33,34)39-12-4-16(38-14(12)8-35-40(30,31)32)24-6-10(2)18(27)22-20(24)29/h5-6,11-16,25H,3-4,7-8H2,1-2H3,(H,33,34)(H,21,26,28)(H,22,27,29)(H2,30,31,32)/t11-,12-,13+,14+,15+,16+/m0/s1 |
| InChIKey | MMXKIWIWQPKTIK-KPRKPIBOSA-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 |