| SpectraBase Compound ID | GheTNJuUdst |
|---|---|
| InChI | InChI=1S/C34H52O7/c1-19(17-25(35)20(2)21(3)30(39)40)22-11-15-34(8)24-9-10-26-31(4,5)27(41-29(38)18-28(36)37)13-14-32(26,6)23(24)12-16-33(22,34)7/h19-22,26-27H,9-18H2,1-8H3,(H,36,37)(H,39,40)/t19-,20+,21?,22-,26+,27-,32-,33-,34+/m1/s1 |
| InChIKey | WWJFQSXVIHXIBB-XGLIZPBPSA-N |
| Mol Weight | 572.8 g/mol |
| Molecular Formula | C34H52O7 |
| Exact Mass | 572.371304 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4VwQZU743xJ |
|---|---|
| Name | 3-ALPHA-CARBOXYACETOXYQUERCINIC-ACID;3-ALPHA-CARBOXYACETOXY-24-METHYL-23-OXOLANOST-8-EN-26-OIC-ACID |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H52O7 |
| InChI | InChI=1S/C34H52O7/c1-19(17-25(35)20(2)21(3)30(39)40)22-11-15-34(8)24-9-10-26-31(4,5)27(41-29(38)18-28(36)37)13-14-32(26,6)23(24)12-16-33(22,34)7/h19-22,26-27H,9-18H2,1-8H3,(H,36,37)(H,39,40)/t19-,20+,21?,22-,26+,27-,32-,33-,34+/m1/s1 |
| InChIKey | WWJFQSXVIHXIBB-XGLIZPBPSA-N |
| Literature Reference Author | J.ROESECKE,W.A.KOENIG |
| Literature Reference Citation | PHYTOCHEM.,54,757(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00130-8 |
| Molecular Weight | 572.783 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU1449 |