| SpectraBase Compound ID | DeXE2K80cm6 |
|---|---|
| InChI | InChI=1S/C22H38N4O12/c1-35-12(28)8-6-4-2-3-5-7-9-36-22-13(15(30)14(29)11(10-27)37-22)24-20(34)19-17(32)16(31)18(33)21(38-19)25-26-23/h11,13-19,21-22,27,29-33H,2-10H2,1H3,(H,24,34)/t11-,13-,14-,15-,16+,17-,18-,19+,21-,22-/m1/s1 |
| InChIKey | CRVANYIFOGGWIJ-TVMGBOEDSA-N |
| Mol Weight | 550.6 g/mol |
| Molecular Formula | C22H38N4O12 |
| Exact Mass | 550.248623 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BKblBexduyj |
|---|---|
| Name | 8-METHOXYCARBONYLOCTYL-2-DEOXY-2-(1-DEOXY-1-AZIDO-BETA-D-GALACTOHEXOPYRANOSYLURONAMIDE)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 4G |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H38N4O12 |
| InChI | InChI=1S/C22H38N4O12/c1-35-12(28)8-6-4-2-3-5-7-9-36-22-13(15(30)14(29)11(10-27)37-22)24-20(34)19-17(32)16(31)18(33)21(38-19)25-26-23/h11,13-19,21-22,27,29-33H,2-10H2,1H3,(H,24,34)/t11-,13-,14-,15-,16+,17-,18-,19+,21-,22-/m1/s1 |
| InChIKey | CRVANYIFOGGWIJ-TVMGBOEDSA-N |
| Literature Reference Author | O.SCHWARDT,G.BAISCH,R.OEHRLEIN |
| Literature Reference Citation | BIOORG.MED.CHEM.,9,1857(2001) |
| Literature Reference DOI | 10.1016/S0968-0896(01)00086-4 |
| Molecular Weight | 550.563 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS21982 |