| SpectraBase Compound ID | 4nFn9ufBGfn |
|---|---|
| InChI | InChI=1S/C35H54O7/c1-20-13-16-35(29(38)40-10)18-17-32(7)23(27(35)34(20,9)39)11-12-26-31(6)19-24(41-21(2)36)28(42-22(3)37)30(4,5)25(31)14-15-33(26,32)8/h11,20,24-28,39H,12-19H2,1-10H3/t20-,24-,25?,26?,27-,28+,31+,32-,33-,34-,35+/m1/s1 |
| InChIKey | YGBIXFIIAJCOLF-JBYHRTJFSA-N |
| Mol Weight | 586.8 g/mol |
| Molecular Formula | C35H54O7 |
| Exact Mass | 586.386954 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GzWFbnn8bbd |
|---|---|
| Name | METHYL-2,3-DIACETYL-TORMENTATE;METHYL-2-ALPHA,3-BETA-DIACETOXY-19-ALPHA-HYDROXY-URS-12-EN-28-OATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H54O7 |
| InChI | InChI=1S/C35H54O7/c1-20-13-16-35(29(38)40-10)18-17-32(7)23(27(35)34(20,9)39)11-12-26-31(6)19-24(41-21(2)36)28(42-22(3)37)30(4,5)25(31)14-15-33(26,32)8/h11,20,24-28,39H,12-19H2,1-10H3/t20-,24-,25?,26?,27-,28+,31+,32-,33-,34-,35+/m1/s1 |
| InChIKey | YGBIXFIIAJCOLF-JBYHRTJFSA-N |
| Literature Reference Author | D.LONTSI,B.L.SONDENGAM,M.T.MARTIN,B.BODO |
| Literature Reference Citation | PHYTOCHEM.,48,171(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00789-9 |
| Molecular Weight | 586.810 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS643 |