| SpectraBase Compound ID | FgpSDWSfER1 |
|---|---|
| InChI | InChI=1S/C34H54O5/c1-19(2)22-13-15-32(8)27(39-21(4)36)18-33(9)23(28(22)32)11-12-25-31(7)16-14-26(38-20(3)35)30(5,6)29(31)24(37)17-34(25,33)10/h22-29,37H,1,11-18H2,2-10H3/t22-,23+,24-,25-,26-,27-,28+,29-,31+,32+,33+,34+/m0/s1 |
| InChIKey | MBHABLRINRDKSC-ATRVNJGQSA-N |
| Mol Weight | 542.8 g/mol |
| Molecular Formula | C34H54O5 |
| Exact Mass | 542.397125 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bouz9nqZARu |
|---|---|
| Name | 3-BETA,16-BETA-DI-O-ACETYL-6-BETA-HYDROXYLUP-20(29)-ENE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H54O5 |
| InChI | InChI=1S/C34H54O5/c1-19(2)22-13-15-32(8)27(39-21(4)36)18-33(9)23(28(22)32)11-12-25-31(7)16-14-26(38-20(3)35)30(5,6)29(31)24(37)17-34(25,33)10/h22-29,37H,1,11-18H2,2-10H3/t22-,23+,24-,25-,26-,27-,28+,29-,31+,32+,33+,34+/m0/s1 |
| InChIKey | MBHABLRINRDKSC-ATRVNJGQSA-N |
| Literature Reference Author | V.A.FACUNDO,C.H.S.ANDRADE,E.R.SILVEIRA,R.BRAZ-FILHO,C.D.HUFF ORD |
| Literature Reference Citation | PHYTOCHEM.,32,411(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95005-2 |
| Molecular Weight | 542.800 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS4518 |