| SpectraBase Compound ID | KacDX2UbUT1 |
|---|---|
| InChI | InChI=1S/C29H36O17/c1-14(30)39-11-20-23(36)25(38)26(42-17(4)33)28(43-20)46-29(13-41-16(3)32)27(24(37)21(45-29)12-40-15(2)31)44-22(35)10-7-18-5-8-19(34)9-6-18/h5-10,20-21,23-28,34,36-38H,11-13H2,1-4H3/b10-7-/t20-,21-,23-,24-,25+,26-,27+,28-,29+/m0/s1 |
| InChIKey | QTCGKWBMZVFTMC-AXIWFGTISA-N |
| Mol Weight | 656.6 g/mol |
| Molecular Formula | C29H36O17 |
| Exact Mass | 656.19525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cu9Y57JLYmz |
|---|---|
| Name | 1,6,2',6'-O-TETRAACETYL-3-O-TRANS-PARA-COUMAROYLSUCROSE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H36O17 |
| InChI | InChI=1S/C29H36O17/c1-14(30)39-11-20-23(36)25(38)26(42-17(4)33)28(43-20)46-29(13-41-16(3)32)27(24(37)21(45-29)12-40-15(2)31)44-22(35)10-7-18-5-8-19(34)9-6-18/h5-10,20-21,23-28,34,36-38H,11-13H2,1-4H3/b10-7-/t20-,21-,23-,24-,25+,26-,27+,28-,29+/m0/s1 |
| InChIKey | QTCGKWBMZVFTMC-AXIWFGTISA-N |
| Literature Reference Author | N.SHIMAZAKI,Y.MIMAKI,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,30,1475(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84190-4 |
| Molecular Weight | 656.595 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU34346 |