| SpectraBase Compound ID | 22rjvsNJVO6 |
|---|---|
| InChI | InChI=1S/C37H46N2O12S2/c1-5-52-33-25(29(46-19-40)27-23(48-33)17-44-31(50-27)21-13-9-7-10-14-21)38-35(42)37(3,4)36(43)39-26-30(47-20-41)28-24(49-34(26)53-6-2)18-45-32(51-28)22-15-11-8-12-16-22/h7-16,19-20,23-34H,5-6,17-18H2,1-4H3,(H,38,42)(H,39,43)/t23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33+,34+/m1/s1 |
| InChIKey | CDYUNHRKXAKALC-MCYCKVDVSA-N |
| Mol Weight | 774.9 g/mol |
| Molecular Formula | C37H46N2O12S2 |
| Exact Mass | 774.249217 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LqzXKIGvaNw |
|---|---|
| Name | N,N'-BIS-(ETHYL-3-O-FORMYL-4,6-O-BENZYLIDENE-2-DEOXY-1-THIO-BETA-D-GLUCOPYRANOSID-2-YL)-DIMETHYLMALONAMIDE |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H46N2O12S2 |
| InChI | InChI=1S/C37H46N2O12S2/c1-5-52-33-25(29(46-19-40)27-23(48-33)17-44-31(50-27)21-13-9-7-10-14-21)38-35(42)37(3,4)36(43)39-26-30(47-20-41)28-24(49-34(26)53-6-2)18-45-32(51-28)22-15-11-8-12-16-22/h7-16,19-20,23-34H,5-6,17-18H2,1-4H3,(H,38,42)(H,39,43)/t23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33+,34+/m1/s1 |
| InChIKey | CDYUNHRKXAKALC-MCYCKVDVSA-N |
| Literature Reference Author | T.MINUTH,M.M.K.BOYSEN |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,6,23,1(2010) |
| Molecular Weight | 774.898 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT10054 |