| SpectraBase Compound ID | 1PkF6oFzytx |
|---|---|
| InChI | InChI=1S/C36H40O16/c1-41-35-31-29(27-21(45-35)17-43-33(51-27)19-9-5-3-6-10-19)47-23(37)13-14-24(38)48-30-28-22(18-44-34(52-28)20-11-7-4-8-12-20)46-36(42-2)32(30)50-26(40)16-15-25(39)49-31/h3-12,21-22,27-36H,13-18H2,1-2H3/t21-,22-,27-,28-,29+,30+,31-,32-,33-,34-,35+,36+/m0/s1 |
| InChIKey | PQCYBNZMBOUDOK-ZNBOARLESA-N |
| Mol Weight | 728.7 g/mol |
| Molecular Formula | C36H40O16 |
| Exact Mass | 728.231635 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8vtkXmnoXT3 |
|---|---|
| Name | BIS-(METHYL-4,6-O-BENZYLIDENE-2-DEOXY-ALPHA-D-GLUCOPYRANOSID-2,3-DIYL-2,2':3,3'-BUTANEDIOATE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H40O16 |
| InChI | InChI=1S/C36H40O16/c1-41-35-31-29(27-21(45-35)17-43-33(51-27)19-9-5-3-6-10-19)47-23(37)13-14-24(38)48-30-28-22(18-44-34(52-28)20-11-7-4-8-12-20)46-36(42-2)32(30)50-26(40)16-15-25(39)49-31/h3-12,21-22,27-36H,13-18H2,1-2H3/t21-,22-,27-,28-,29+,30+,31-,32-,33-,34-,35+,36+/m0/s1 |
| InChIKey | PQCYBNZMBOUDOK-ZNBOARLESA-N |
| Literature Reference Author | H.NAMAZI,T.B.GRINDLEY |
| Literature Reference Citation | CAN.J.CHEM.,75,983(1997) |
| Literature Reference DOI | 10.1139/v97-118 |
| Molecular Weight | 728.704 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP2471 |