#3;SIPHOLENONE_E;(5A-S,6-S,7-S,9A-S)-7-HYDROXY-6-((E)-2-((2-R,4A-S,5-S,8A-R)-5-HYDROXY-2,5,8,8-TETRAMETHYLOCTAHYDRONAPHTHALEN-1-(2-H)-YLIDENE)-ETHYL)-2,2,5A,7-
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 3GFTldcEtU2 |
|---|---|
| InChI | InChI=1S/C30H50O4/c1-19-9-11-21-25(26(2,3)17-18-29(21,7)32)20(19)10-12-22-28(6)15-13-23(31)27(4,5)34-24(28)14-16-30(22,8)33/h10,19,21-22,24-25,32-33H,9,11-18H2,1-8H3/b20-10-/t19-,21+,22+,24+,25-,28+,29+,30+/m1/s1 |
| InChIKey | DPIZIYOJDMMKNP-OMWQVJEDSA-N |
| Mol Weight | 474.7 g/mol |
| Molecular Formula | C30H50O4 |
| Exact Mass | 474.37091 g/mol |
| Enantiomer InChIKey | DPIZIYOJDMMKNP-ZTHIVFRQSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Title | Journal or Book | Year |
|---|---|---|
| Sipholane Triterpenoids: Chemistry, Reversal of ABCB1/P-Glycoprotein-Mediated Multidrug Resistance, and Pharmacophore Modeling | Journal of Natural Products | 2009 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.