| SpectraBase Compound ID | DNv00wxs03T |
|---|---|
| InChI | InChI=1S/C23H30ClNO5/c1-13(26)23(29)14-10-16-19(2)7-5-8-20(3,18(28)30-4)15(19)6-9-22(16,17(23)27)21(24,11-14)12-25/h14-16,29H,5-11H2,1-4H3/t14-,15-,16-,19+,20-,21+,22-,23+/m1/s1 |
| InChIKey | KONXWTXVYIUWBI-MABKBLCISA-N |
| Mol Weight | 435.95 g/mol |
| Molecular Formula | C23H30ClNO5 |
| Exact Mass | 435.181251 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9u4seMgM4tW |
|---|---|
| Name | METHYL-(4-ALPHA,13R,15-ALPHA)-13-ACETYL-15-CHLORO-15-CYANO-13-HYDROXY-14-OXO-17,19-DINORATISAN-4-CARBOXYLATE |
| Compound Number | 15 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H30ClNO5 |
| InChI | InChI=1S/C23H30ClNO5/c1-13(26)23(29)14-10-16-19(2)7-5-8-20(3,18(28)30-4)15(19)6-9-22(16,17(23)27)21(24,11-14)12-25/h14-16,29H,5-11H2,1-4H3/t14-,15-,16-,19+,20-,21+,22-,23+/m1/s1 |
| InChIKey | KONXWTXVYIUWBI-MABKBLCISA-N |
| Literature Reference Author | D.HOFNER,E.HASLINGER |
| Literature Reference Citation | MH.CHEM.,129,393(1998) |
| Literature Reference DOI | 10.1007/s007060050059 |
| Molecular Weight | 435.948 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU2726 |