| SpectraBase Compound ID | GQIUbf5enRH |
|---|---|
| InChI | InChI=1S/C31H50O6/c1-17-11-14-31(25(35)37-8)16-15-27(4)18(22(31)30(17,7)36)9-10-20-28(27,5)13-12-19-26(2,3)23(33)21(32)24(34)29(19,20)6/h9,17,19-24,32-34,36H,10-16H2,1-8H3/t17-,19?,20?,21+,22?,23+,24+,27-,28-,29+,30-,31+/m1/s1 |
| InChIKey | QIENFPGBPQGUPZ-UJZXXQSQSA-N |
| Mol Weight | 518.7 g/mol |
| Molecular Formula | C31H50O6 |
| Exact Mass | 518.360739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KlU9u9kaj8G |
|---|---|
| Name | METHYL-1-ALPHA,2-ALPHA,3-BETA,19-ALPHA-TETRAHYDROXY-URS-12-EN-28-OATE |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O6 |
| InChI | InChI=1S/C31H50O6/c1-17-11-14-31(25(35)37-8)16-15-27(4)18(22(31)30(17,7)36)9-10-20-28(27,5)13-12-19-26(2,3)23(33)21(32)24(34)29(19,20)6/h9,17,19-24,32-34,36H,10-16H2,1-8H3/t17-,19?,20?,21+,22?,23+,24+,27-,28-,29+,30-,31+/m1/s1 |
| InChIKey | QIENFPGBPQGUPZ-UJZXXQSQSA-N |
| Literature Reference Author | B.Z.LI,B.G.WANG,Z.J.JIA |
| Literature Reference Citation | PHYTOCHEM.,49,2477(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00161-7 |
| Molecular Weight | 518.734 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU1090 |