(3-ALPHA,7-ALPHA,12-ALPHA)-TRIHYDROXY-5-BETA-CHOLANIC-ACID-3,5,6-TRIMETHYL-PYRAZIN-2-METHYLESTER
Compound with spectra: 1 NMR
| SpectraBase Compound ID | JmPA90GmaHn |
|---|---|
| InChI | InChI=1S/C32H50N2O5/c1-17(7-10-29(38)39-16-26-20(4)33-18(2)19(3)34-26)23-8-9-24-30-25(15-28(37)32(23,24)6)31(5)12-11-22(35)13-21(31)14-27(30)36/h17,21-25,27-28,30,35-37H,7-16H2,1-6H3/t17-,21+,22-,23-,24+,25+,27-,28+,30+,31+,32-/m1/s1 |
| InChIKey | ICGZMGODDXJRMR-KLQGMSDESA-N |
| Mol Weight | 542.8 g/mol |
| Molecular Formula | C32H50N2O5 |
| Exact Mass | 542.371973 g/mol |
| Enantiomer InChIKey | ICGZMGODDXJRMR-YVKWZZRQSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
N-(4N-methylpiperazin-1-yl)-3.alpha.,7.alpha.,12.alpha.-trihydroxy-5.beta.-cholan-24-amide
Cholic acid N-benzylamide
TCA;Y-4
Taurocholic acid
2-[[(4R)-1-oxo-4-[(3R,5R,7R,10S,12S,13R,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]amino]ethanesulfonic acid
Methyl glycocholate
Methyl glycoallocholate
3-ALPHA,7-ALPHA,12-ALPHA-TRIHYDROXY-5-BETA-CHOLAN-24-OIC-N-(PYRIDIN-4-YL)-AMIDE-ETHANOL-SOLVATE
3-ALPHA,7-ALPHA,12-ALPHA-TRIHYDROXY-5-BETA-CHOLAN-24-OIC-N-(PYRIDIN-4-YL)-AMIDE-ANHYDROUS-FORM
3-ALPHA,7-ALPHA,12-ALPHA-TRIHYDROXY-5-BETA-CHOLAN-24-OIC-N-(PYRIDIN-4-YL)-AMIDE
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis and Biological Evaluation of New Ligustrazine Derivatives as Anti-Tumor Agents | Molecules | 2012 |
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.