![[METHYL-3-AZIDO-2,3-DIDEOXY-N-((1'S)-1'-[(3''S)-3'',4''-DIHYDRO-8''-HYDROXY-1''-OXO-1''H-2''-BENZOPYRAN-3''-YL]-3'-METHYLBUTYL)-ALPHA-D-RIBO-HEXOFURANOSID]-URONAMIDE](/api/spectrum/1jNdqoyiGVV/structure.png?h=300&w=458 "[METHYL-3-AZIDO-2,3-DIDEOXY-N-((1'S)-1'-[(3''S)-3'',4''-DIHYDRO-8''-HYDROXY-1''-OXO-1''H-2''-BENZOPYRAN-3''-YL]-3'-METHYLBUTYL)-ALPHA-D-RIBO-HEXOFURANOSID]-URONAMIDE")
| SpectraBase Compound ID | Hr8IhgdPBx3 |
|---|---|
| InChI | InChI=1S/C21H28N4O7/c1-10(2)7-12(15-8-11-5-4-6-14(26)17(11)21(29)31-15)23-20(28)18(27)19-13(24-25-22)9-16(30-3)32-19/h4-6,10,12-13,15-16,18-19,26-27H,7-9H2,1-3H3,(H,23,28)/t12-,13+,15-,16+,18-,19+/m0/s1 |
| InChIKey | UFAGUARTKCQZQZ-RZRNGHBGSA-N |
| Mol Weight | 448.48 g/mol |
| Molecular Formula | C21H28N4O7 |
| Exact Mass | 448.195799 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1jNdqoyiGVV |
|---|---|
| Name | [METHYL-3-AZIDO-2,3-DIDEOXY-N-((1'S)-1'-[(3''S)-3'',4''-DIHYDRO-8''-HYDROXY-1''-OXO-1''H-2''-BENZOPYRAN-3''-YL]-3'-METHYLBUTYL)-ALPHA-D-RIBO-HEXOFURANOSID]-URONAMIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H28N4O7 |
| InChI | InChI=1S/C21H28N4O7/c1-10(2)7-12(15-8-11-5-4-6-14(26)17(11)21(29)31-15)23-20(28)18(27)19-13(24-25-22)9-16(30-3)32-19/h4-6,10,12-13,15-16,18-19,26-27H,7-9H2,1-3H3,(H,23,28)/t12-,13+,15-,16+,18-,19+/m0/s1 |
| InChIKey | UFAGUARTKCQZQZ-RZRNGHBGSA-N |
| Literature Reference Author | J.M.DURGNAT,P.VOGEL |
| Literature Reference Citation | HELV.CHIM.ACTA,76,222(1993) |
| Literature Reference DOI | 10.1002/hlca.19930760116 |
| Molecular Weight | 448.476 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS16202 |