| SpectraBase Compound ID | 2BjNhxeB6dE |
|---|---|
| InChI | InChI=1S/C22H32O6/c1-8-14(4)19(25)27-18-9-10-20(6)12-17(24)22(26,13(2)3)11-16(20)21(18,7)28-15(5)23/h8,16,18,26H,2,9-12H2,1,3-7H3/b14-8+/t16-,18+,20-,21-,22+/m1/s1 |
| InChIKey | XORCRDBQZLFCPU-IRTZTYLTSA-N |
| Mol Weight | 392.5 g/mol |
| Molecular Formula | C22H32O6 |
| Exact Mass | 392.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CEyTdtCibk9 |
|---|---|
| Name | 4-BETA-ACETOXY-3-BETA-ANGELOYLOXY-7-ALPHA-HYDROXY-11,12-DEHYDROEUDESMAN-8-ONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H32O6 |
| InChI | InChI=1S/C22H32O6/c1-8-14(4)19(25)27-18-9-10-20(6)12-17(24)22(26,13(2)3)11-16(20)21(18,7)28-15(5)23/h8,16,18,26H,2,9-12H2,1,3-7H3/b14-8+/t16-,18+,20-,21-,22+/m1/s1 |
| InChIKey | XORCRDBQZLFCPU-IRTZTYLTSA-N |
| Literature Reference Author | G.M.S.P.GUILHON,A.H.MUELLER |
| Literature Reference Citation | PHYTOCHEM.,47,227(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00556-6 |
| Molecular Weight | 392.492 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS30 |