![ISOMER_1;1-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYLMETHYL)-BETA-DHRO-PENTOFURANOSYL]-4-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-3-(2-PHENYLETHYNYL)](/api/spectrum/9nuGdKXaHJT/structure.png?h=300&w=458 "ISOMER_1;1-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYLMETHYL)-BETA-DHRO-PENTOFURANOSYL]-4-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-3-(2-PHENYLETHYNYL)")
| SpectraBase Compound ID | JckNTRSawyX |
|---|---|
| InChI | InChI=1S/C51H57N8O6P/c1-36(2)59(37(3)4)66(63-31-15-30-52)65-45-32-47(58-50-48(49(53-34-54-50)55-35-57(5)6)44(56-58)29-20-38-16-11-9-12-17-38)64-46(45)33-62-51(39-18-13-10-14-19-39,40-21-25-42(60-7)26-22-40)41-23-27-43(61-8)28-24-41/h9-14,16-19,21-28,34-37,45-47H,15,31-33H2,1-8H3/b55-35+/t45-,46+,47+,66?/m0/s1 |
| InChIKey | SGGDDWQNXVTZMW-FKLNTMIOSA-N |
| Mol Weight | 909.0 g/mol |
| Molecular Formula | C51H57N8O6P |
| Exact Mass | 908.413869 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9nuGdKXaHJT |
|---|---|
| Name | ISOMER_2;1-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRIPHENYLMETHYL)-BETA-DHRO-PENTOFURANOSYL]-4-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-3-(2-PHENYLETHYNYL) |
| Compound Number | 2D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H57N8O6P |
| InChI | InChI=1S/C51H57N8O6P/c1-36(2)59(37(3)4)66(63-31-15-30-52)65-45-32-47(58-50-48(49(53-34-54-50)55-35-57(5)6)44(56-58)29-20-38-16-11-9-12-17-38)64-46(45)33-62-51(39-18-13-10-14-19-39,40-21-25-42(60-7)26-22-40)41-23-27-43(61-8)28-24-41/h9-14,16-19,21-28,34-37,45-47H,15,31-33H2,1-8H3/b55-35+/t45-,46+,47+,66?/m0/s1 |
| InChIKey | SGGDDWQNXVTZMW-FKLNTMIOSA-N |
| Literature Reference Author | F.SEELA,M.ZULAUF |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,479(1999) |
| Literature Reference DOI | 10.1039/a808769e |
| Solvent | CDCl3 |
| Source File Reference | UWMZ11252 |