![3-AMINO-4-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-1,2,4-TRIAZIN-5-(4H)-ONE](/api/spectrum/6tNpB9XWWbk/structure.png?h=300&w=458 "3-AMINO-4-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-1,2,4-TRIAZIN-5-(4H)-ONE")
| SpectraBase Compound ID | BR1es3Fi1p6 |
|---|---|
| InChI | InChI=1S/C29H30N4O6/c1-36-22-12-8-20(9-13-22)29(19-6-4-3-5-7-19,21-10-14-23(37-2)15-11-21)38-18-25-24(34)16-27(39-25)33-26(35)17-31-32-28(33)30/h3-15,17,24-25,27,34H,16,18H2,1-2H3,(H2,30,32)/t24-,25+,27+/m0/s1 |
| InChIKey | KLMYZGOAXMDJCM-ZWEKWIFMSA-N |
| Mol Weight | 530.58 g/mol |
| Molecular Formula | C29H30N4O6 |
| Exact Mass | 530.216535 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6tNpB9XWWbk |
|---|---|
| Name | 3-AMINO-4-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-1,2,4-TRIAZIN-5-(4H)-ONE |
| Compound Number | 11B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H30N4O6 |
| InChI | InChI=1S/C29H30N4O6/c1-36-22-12-8-20(9-13-22)29(19-6-4-3-5-7-19,21-10-14-23(37-2)15-11-21)38-18-25-24(34)16-27(39-25)33-26(35)17-31-32-28(33)30/h3-15,17,24-25,27,34H,16,18H2,1-2H3,(H2,30,32)/t24-,25+,27+/m0/s1 |
| InChIKey | KLMYZGOAXMDJCM-ZWEKWIFMSA-N |
| Literature Reference Author | F.SEELA,Y.HE |
| Literature Reference Citation | J.ORG.CHEM.,68,367(2003) |
| Literature Reference DOI | 10.1021/jo020507n |
| Molecular Weight | 530.580 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN25023 |