| SpectraBase Compound ID | KeJ6Dxp7QqS |
|---|---|
| InChI | InChI=1S/C29H40O12/c1-16(9-11-29(35)17(2)13-22(34)14-28(29,7)8)10-12-36-27-26(40-21(6)33)25(39-20(5)32)24(38-19(4)31)23(41-27)15-37-18(3)30/h9-11,13,23-27,35H,12,14-15H2,1-8H3/b11-9+,16-10+/t23-,24-,25+,26-,27-,29+/m0/s1 |
| InChIKey | NFCAKEXGLFFGIW-DFRNZBGQSA-N |
| Mol Weight | 580.6 g/mol |
| Molecular Formula | C29H40O12 |
| Exact Mass | 580.251977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B62dxBz7l1F |
|---|---|
| Name | TRANS-ABSCISIC-ALCOHOL-BETA-D-2,3,4,6-TETRA-O-ACETYL-GLUCOPYRANOSIDE |
| Compound Number | 4A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H40O12 |
| InChI | InChI=1S/C29H40O12/c1-16(9-11-29(35)17(2)13-22(34)14-28(29,7)8)10-12-36-27-26(40-21(6)33)25(39-20(5)32)24(38-19(4)31)23(41-27)15-37-18(3)30/h9-11,13,23-27,35H,12,14-15H2,1-8H3/b11-9+,16-10+/t23-,24-,25+,26-,27-,29+/m0/s1 |
| InChIKey | NFCAKEXGLFFGIW-DFRNZBGQSA-N |
| Literature Reference Author | A.LUTZ,P.WINTERHALTER |
| Literature Reference Citation | PHYTOCHEM.,32,57(1993) |
| Literature Reference DOI | 10.1016/0031-9422(92)80106-O |
| Molecular Weight | 580.629 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS3518 |