| SpectraBase Compound ID | 3aBf8n162Rb |
|---|---|
| InChI | InChI=1S/C33H34N2O12/c1-33(2,31-34-21-25(40-15-36)23-19(42-29(21)46-31)13-38-27(44-23)17-9-5-3-6-10-17)32-35-22-26(41-16-37)24-20(43-30(22)47-32)14-39-28(45-24)18-11-7-4-8-12-18/h3-12,15-16,19-30H,13-14H2,1-2H3/t19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-/m1/s1 |
| InChIKey | FYSHPKZDNVGFCT-BVOLDIKBSA-N |
| Mol Weight | 650.6 g/mol |
| Molecular Formula | C33H34N2O12 |
| Exact Mass | 650.211175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Lzqh9rNaF |
|---|---|
| Name | 3-O-FORMYL-GLUCO-BOX |
| Compound Number | 26 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H34N2O12 |
| InChI | InChI=1S/C33H34N2O12/c1-33(2,31-34-21-25(40-15-36)23-19(42-29(21)46-31)13-38-27(44-23)17-9-5-3-6-10-17)32-35-22-26(41-16-37)24-20(43-30(22)47-32)14-39-28(45-24)18-11-7-4-8-12-18/h3-12,15-16,19-30H,13-14H2,1-2H3/t19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-/m1/s1 |
| InChIKey | FYSHPKZDNVGFCT-BVOLDIKBSA-N |
| Literature Reference Author | T.MINUTH,M.M.K.BOYSEN |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,6,23,1(2010) |
| Molecular Weight | 650.639 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT10055 |