| SpectraBase Compound ID | 7G9wZ3qMtZR |
|---|---|
| InChI | InChI=1S/2C20H25N4O11P/c2*1-9-5-23(19(28)21-17(9)26)15-3-11(25)13(33-15)7-31-36(30)32-8-14-12(35-36)4-16(34-14)24-6-10(2)18(27)22-20(24)29/h2*5-6,11-16,25H,3-4,7-8H2,1-2H3,(H,21,26,28)(H,22,27,29)/t2*11-,12-,13+,14-,15+,16-,36?/m00/s1 |
| InChIKey | PKCXKYHJPKROKC-UTMPQDEPSA-N |
| Mol Weight | 1056.82 g/mol |
| Molecular Formula | C40H50N8O22P2 |
| Exact Mass | 1056.251489 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | El6xoh4ytGE |
|---|---|
| Name | DITHYMIDYLYL-CYCLIC-3',5'-PHOSPHOROTHIOATE |
| Compound Number | 21 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H50N8O22P2 |
| InChI | InChI=1S/2C20H25N4O11P/c2*1-9-5-23(19(28)21-17(9)26)15-3-11(25)13(33-15)7-31-36(30)32-8-14-12(35-36)4-16(34-14)24-6-10(2)18(27)22-20(24)29/h2*5-6,11-16,25H,3-4,7-8H2,1-2H3,(H,21,26,28)(H,22,27,29)/t2*11-,12-,13+,14-,15+,16-,36?/m00/s1 |
| InChIKey | PKCXKYHJPKROKC-UTMPQDEPSA-N |
| Literature Reference Author | K.MISIURA,D.SZYMANOWICZ,H.KUSNIERCZYK |
| Literature Reference Citation | BIOORG.MED.CHEM.,9,1525(2001) |
| Literature Reference DOI | 10.1016/S0968-0896(01)00025-6 |
| Solvent | CD3CN |
| Source File Reference | UWSI21108 |