![3-AMINO-2-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-METHYL-1,2,4-TRIAZIN-5-(2H)-ONE](/api/spectrum/QGqu0RpRGT/structure.png?h=300&w=458 "3-AMINO-2-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-METHYL-1,2,4-TRIAZIN-5-(2H)-ONE")
| SpectraBase Compound ID | HYvuo2OjnFK |
|---|---|
| InChI | InChI=1S/C30H32N4O6/c1-19-28(36)32-29(31)34(33-19)27-17-25(35)26(40-27)18-39-30(20-7-5-4-6-8-20,21-9-13-23(37-2)14-10-21)22-11-15-24(38-3)16-12-22/h4-16,25-27,35H,17-18H2,1-3H3,(H2,31,32,36)/t25-,26+,27+/m0/s1 |
| InChIKey | ZALDWKREGWRRGQ-OYUWMTPXSA-N |
| Mol Weight | 544.6 g/mol |
| Molecular Formula | C30H32N4O6 |
| Exact Mass | 544.232185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | QGqu0RpRGT |
|---|---|
| Name | 3-AMINO-2-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-6-METHYL-1,2,4-TRIAZIN-5-(2H)-ONE |
| Compound Number | 10A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H32N4O6 |
| InChI | InChI=1S/C30H32N4O6/c1-19-28(36)32-29(31)34(33-19)27-17-25(35)26(40-27)18-39-30(20-7-5-4-6-8-20,21-9-13-23(37-2)14-10-21)22-11-15-24(38-3)16-12-22/h4-16,25-27,35H,17-18H2,1-3H3,(H2,31,32,36)/t25-,26+,27+/m0/s1 |
| InChIKey | ZALDWKREGWRRGQ-OYUWMTPXSA-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 | 544.607 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN25024 |