| SpectraBase Compound ID | IVGpxXrvovQ |
|---|---|
| InChI | InChI=1S/C23H31Cl2NO4/c1-4-5-6-7-8-15(2)11-16(3)9-10-20(27)26-19-14-23(30-22(19)29)12-17(24)21(28)18(25)13-23/h9-13,15,19,22,29H,4-8,14H2,1-3H3,(H,26,27)/b10-9+,16-11+/t15-,19+,22-/m1/s1 |
| InChIKey | NGXMXBNROHVABT-JSWNYRKASA-N |
| Mol Weight | 456.41 g/mol |
| Molecular Formula | C23H31Cl2NO4 |
| Exact Mass | 455.163014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ErFflJva70r |
|---|---|
| Name | GYMNASTATIN-A |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H31Cl2NO4 |
| InChI | InChI=1S/C23H31Cl2NO4/c1-4-5-6-7-8-15(2)11-16(3)9-10-20(27)26-19-14-23(30-22(19)29)12-17(24)21(28)18(25)13-23/h9-13,15,19,22,29H,4-8,14H2,1-3H3,(H,26,27)/b10-9+,16-11+/t15-,19+,22-/m1/s1 |
| InChIKey | NGXMXBNROHVABT-JSWNYRKASA-N |
| Literature Reference Author | T.AMAGATA,M.DOI,T.OHTA,K.MINOURA,A.NUMATA |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,3585(1998) |
| Literature Reference DOI | 10.1039/a804466j |
| Molecular Weight | 456.409 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP9037 |