![3-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-5-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-3,6-DIHYDRO-7H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-7-ON](/api/spectrum/18c1cJROnQ/structure.png?h=300&w=458 "3-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-5-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-3,6-DIHYDRO-7H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-7-ON")
| SpectraBase Compound ID | 1u7N90f6BaA |
|---|---|
| InChI | InChI=1S/C33H36N7O8P.C6H15N/c1-39(2)20-34-32-35-30-29(31(41)36-32)37-38-40(30)28-18-26(48-49(42)43)27(47-28)19-46-33(21-8-6-5-7-9-21,22-10-14-24(44-3)15-11-22)23-12-16-25(45-4)17-13-23;1-4-7(5-2)6-3/h5-17,20,26-28,49H,18-19H2,1-4H3,(H,42,43)(H,35,36,41);4-6H2,1-3H3/b34-20+;/t26-,27+,28+;/m0./s1 |
| InChIKey | GNKNZMICSCGZEK-ZSZFJDNVSA-N |
| Mol Weight | 790.9 g/mol |
| Molecular Formula | C39H51N8O8P |
| Exact Mass | 790.356748 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 18c1cJROnQ |
|---|---|
| Name | 3-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-5-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-3,6-DIHYDRO-7H-1,2,3-TRIAZOLO[4,5-D]PYRIMIDIN-7-ON |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H51N8O8P |
| InChI | InChI=1S/C33H36N7O8P.C6H15N/c1-39(2)20-34-32-35-30-29(31(41)36-32)37-38-40(30)28-18-26(48-49(42)43)27(47-28)19-46-33(21-8-6-5-7-9-21,22-10-14-24(44-3)15-11-22)23-12-16-25(45-4)17-13-23;1-4-7(5-2)6-3/h5-17,20,26-28,49H,18-19H2,1-4H3,(H,42,43)(H,35,36,41);4-6H2,1-3H3/b34-20+;/t26-,27+,28+;/m0./s1 |
| InChIKey | GNKNZMICSCGZEK-ZSZFJDNVSA-N |
| Literature Reference Author | F.SEELA,S.LAMPE |
| Literature Reference Citation | HELV.CHIM.ACTA,77,1003(1994) |
| Literature Reference DOI | 10.1002/hlca.19940770413 |
| Solvent | DMSO-D6 |
| Source File Reference | UWPR1231 |