| SpectraBase Compound ID | 9AmEurIAiqR |
|---|---|
| InChI | InChI=1S/C20H32O5/c1-17-8-13(22)9-18(2,16(23)24)14(17)5-6-19-7-12(3-4-15(17)19)20(25,10-19)11-21/h12-15,21-22,25H,3-11H2,1-2H3,(H,23,24)/t12-,13+,14+,15+,17-,18-,19+,20+/m1/s1 |
| InChIKey | KYHGWSNWELNMFW-XUKSYQPQSA-N |
| Mol Weight | 352.5 g/mol |
| Molecular Formula | C20H32O5 |
| Exact Mass | 352.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HtlEUqMpecM |
|---|---|
| Name | 2-BETA,16-ALPHA,17-TRIHYDROXY-ENT-KAURAN-19-OIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O5 |
| InChI | InChI=1S/C20H32O5/c1-17-8-13(22)9-18(2,16(23)24)14(17)5-6-19-7-12(3-4-15(17)19)20(25,10-19)11-21/h12-15,21-22,25H,3-11H2,1-2H3,(H,23,24)/t12-,13+,14+,15+,17-,18-,19+,20+/m1/s1 |
| InChIKey | KYHGWSNWELNMFW-XUKSYQPQSA-N |
| Literature Reference Author | E.OHKOSHI,S.KAMO,M.MAKINO,Y.FUJIMOTO |
| Literature Reference Citation | PHYTOCHEM.,65,885(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2004.02.020 |
| Molecular Weight | 352.471 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN31210 |