3.alpha.-Hydroxy-13.alpha.-Ursan-28,12.beta.-olide - 3-Benzoate
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 3QSbnfIoSi9 |
|---|---|
| InChI | InChI=1S/C37H52O4/c1-22-13-18-37-20-19-36(7)30(29(37)23(22)2)25(40-32(37)39)21-27-34(5)16-15-28(41-31(38)24-11-9-8-10-12-24)33(3,4)26(34)14-17-35(27,36)6/h8-12,22-23,25-30H,13-21H2,1-7H3/t22?,23-,25+,26?,27?,28+,29?,30-,34-,35+,36+,37-/m0/s1 |
| InChIKey | XBUHCLCBBZQYKL-DJPFKCJHSA-N |
| Mol Weight | 560.8 g/mol |
| Molecular Formula | C37H52O4 |
| Exact Mass | 560.38656 g/mol |
| Enantiomer InChIKey | XBUHCLCBBZQYKL-ZJSLCAHJSA-N |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Title | Journal or Book | Year |
|---|---|---|
| New Triterpenoids of Mallotus repandus | Journal of Natural Products | 1999 |
This compound is available in the following databases:
KnowItAll Mass Spectral Library
Author: Wiley
The KnowItAll Mass Spectral Library offers a comprehensive collection of mass spectra, including the renowned Wiley Registry, and access to a wide range of compounds including pure organics, drugs, steroids, additives, geochemicals, petrochemicals, biomarkers, and more. Learn more.
Wiley Registry of Mass Spectral Data 2023
Author: Wiley
The foundation library for any analytical laboratory running mass spectrometry, the Wiley Registry provides the broadest coverage available in any mass spectral library Learn more.