| SpectraBase Compound ID | K6RrvM7UgZv |
|---|---|
| InChI | InChI=1S/C37H50N2O11/c1-7-38-17-33(18-50-31(42)20-10-8-9-11-22(20)39-25(40)14-19(2)30(39)41)13-12-24(47-4)36-28(33)29(49-6)37(45,32(36)38)35(44)16-23(46-3)21-15-34(36,43)27(35)26(21)48-5/h8-11,19,21,23-24,26-29,32,43-45H,7,12-18H2,1-6H3/t19-,21+,23-,24-,26-,27?,28+,29-,32-,33-,34-,35+,36+,37+/m0/s1 |
| InChIKey | DYNOEUZCEHQMPL-OPQMLPCDSA-N |
| Mol Weight | 698.8 g/mol |
| Molecular Formula | C37H50N2O11 |
| Exact Mass | 698.34146 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GnjSDKYs99m |
|---|---|
| Name | 10-HYDROXYMETHYLLYCACONITINE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H50N2O11 |
| InChI | InChI=1S/C37H50N2O11/c1-7-38-17-33(18-50-31(42)20-10-8-9-11-22(20)39-25(40)14-19(2)30(39)41)13-12-24(47-4)36-28(33)29(49-6)37(45,32(36)38)35(44)16-23(46-3)21-15-34(36,43)27(35)26(21)48-5/h8-11,19,21,23-24,26-29,32,43-45H,7,12-18H2,1-6H3/t19-,21+,23-,24-,26-,27?,28+,29-,32-,33-,34-,35+,36+,37+/m0/s1 |
| InChIKey | DYNOEUZCEHQMPL-OPQMLPCDSA-N |
| Literature Reference Author | N.BATBAYAR,S.ENKHZAYA,J.TUNSAG,D.BATSUREN,D.S.RYCROFT,S.SPRO LL,F.BRACHER |
| Literature Reference Citation | PHYTOCHEM.,62,543(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(02)00514-9 |
| Molecular Weight | 698.811 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN26839 |