| SpectraBase Compound ID | DGfEBtKiZ58 |
|---|---|
| InChI | InChI=1S/C22H33NO7/c1-4-23-8-19-13(30-19)6-12(24)21-10-5-9-11(28-2)7-20(26,14(10)15(9)25)22(27,18(21)23)17(29-3)16(19)21/h9-18,24-27H,4-8H2,1-3H3/t9-,10?,11+,12+,13+,14?,15+,16?,17+,18?,19+,20-,21+,22-/m1/s1 |
| InChIKey | LQCJJMPZGLBYHH-DRELSELBSA-N |
| Mol Weight | 423.5 g/mol |
| Molecular Formula | C22H33NO7 |
| Exact Mass | 423.225702 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3bZs9qLsOuk |
|---|---|
| Name | 14-DEMETHYL-TUGUACONITINE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H33NO7 |
| InChI | InChI=1S/C22H33NO7/c1-4-23-8-19-13(30-19)6-12(24)21-10-5-9-11(28-2)7-20(26,14(10)15(9)25)22(27,18(21)23)17(29-3)16(19)21/h9-18,24-27H,4-8H2,1-3H3/t9-,10?,11+,12+,13+,14?,15+,16?,17+,18?,19+,20-,21+,22-/m1/s1 |
| InChIKey | LQCJJMPZGLBYHH-DRELSELBSA-N |
| Literature Reference Author | P.M.SHRESTHA,A.KATZ |
| Literature Reference Citation | J.NAT.PROD.,63,2(2000) |
| Literature Reference DOI | 10.1021/np990250x |
| Molecular Weight | 423.507 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU1616 |