| SpectraBase Compound ID | 4dY92acv1WA |
|---|---|
| InChI | InChI=1S/C18H28N2O9/c1-10(21)20-14-13(12(22)11-8-27-16(2,3)28-11)29-18(26-5,15(23)25-4)9-17(14,24)6-7-19/h11-14,22,24H,6,8-9H2,1-5H3,(H,20,21)/t11-,12+,13-,14-,17+,18-/m1/s1 |
| InChIKey | NIWLVBHTZYSMIV-HWAOXGGSSA-N |
| Mol Weight | 416.43 g/mol |
| Molecular Formula | C18H28N2O9 |
| Exact Mass | 416.17948 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BnhGKloiRdf |
|---|---|
| Name | METHYL_(METHYL_5-ACETAMIDO-4-C-CYANOMETHYL-3,5-DIDEOXY-8,9-O-ISOPROPYLIDENE-BETA-D-GLYCERO-D-TALO-2-NONULOPYRANOSID)-ONATE |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H28N2O9 |
| InChI | InChI=1S/C18H28N2O9/c1-10(21)20-14-13(12(22)11-8-27-16(2,3)28-11)29-18(26-5,15(23)25-4)9-17(14,24)6-7-19/h11-14,22,24H,6,8-9H2,1-5H3,(H,20,21)/t11-,12+,13-,14-,17+,18-/m1/s1 |
| InChIKey | NIWLVBHTZYSMIV-HWAOXGGSSA-N |
| Literature Reference Author | D.R.GROVES,M.VONITZSTEIN |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2817(1996) |
| Literature Reference DOI | 10.1039/p19960002817 |
| Molecular Weight | 416.428 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ3178 |