EPI-CHOLESTEROL-PARA-NITROBENZOATE-ESTER;(VITAMIN-D-DERIVATIVE)
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 6MGYnKKZQ4r |
|---|---|
| InChI | InChI=1S/C34H49NO4/c1-22(2)7-6-8-23(3)29-15-16-30-28-14-11-25-21-27(17-19-33(25,4)31(28)18-20-34(29,30)5)39-32(36)24-9-12-26(13-10-24)35(37)38/h9-13,22-23,27-31H,6-8,14-21H2,1-5H3/t23-,27-,28+,29-,30+,31+,33+,34-/m1/s1 |
| InChIKey | MCSXGHLTXBACQB-VTVUIIHSSA-N |
| Mol Weight | 535.8 g/mol |
| Molecular Formula | C34H49NO4 |
| Exact Mass | 535.366159 g/mol |
| Enantiomer InChIKey | MCSXGHLTXBACQB-HSHCWKMHSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
3-CHOLESTERYL-PARA-AMINOBENZOATE;(CAB)
3-CHOLESTERYL-PARA-ISOCYANOBENZOATE;(CIB)
CHOLEST-5-EN-3-YL BENZOATE
(3.beta.,20R,24R)-3-(4-nitrobenzoxy)ergost-5-ene
(3.beta.,20R,24R)-3-(4-bromobenzoxy)ergost-5-ene
(3.beta.,20R,24R)-3-(4-chlorobenzoxy)ergost-5-ene
(3.beta)-26,27-Dinorergost-5-en-3-ol benzoate
26,27-Dinorergost-5-en-3-ol, benzoate, (3.beta.)-
(3.beta.,20R,24R)-3-(4-fluorobenzoxy)ergost-5-ene
| Title | Journal or Book | Year |
|---|---|---|
| Conformational analysis of vitamin D and analogs. 1. Carbon-13 and proton nuclear magnetic resonance study | The Journal of Organic Chemistry | 1977 |
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.