N-(2-THIOETHYL)-3-ALPHA,7-BETA-DIHYDROXY-5-BETA-CHOLAN-24-AMIDE
Compound with spectra: 1 NMR
| SpectraBase Compound ID | E7B3GvTa8Mw |
|---|---|
| InChI | InChI=1S/C26H45NO3S/c1-16(4-7-23(30)27-12-13-31)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29/h16-22,24,28-29,31H,4-15H2,1-3H3,(H,27,30)/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-/m1/s1 |
| InChIKey | RAERMPYSSQSNPH-LBSADWJPSA-N |
| Mol Weight | 451.7 g/mol |
| Molecular Formula | C26H45NO3S |
| Exact Mass | 451.312015 g/mol |
| Enantiomer InChIKey | RAERMPYSSQSNPH-ZBKIKLAZSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
TAURODEOXYCHOLIC-ACID;Y-1-B
TCDA;Y-1-A
5b-Cholanic acid-3a,7a-diol N-(carboxymethyl)-amide sodium salt
Glycochenodeoxycholic acid
Methyl glycochenodeoxycholate
ursodeoxycholic acid N-benzylamide
3-ALPHA,7-ALPHA-DIHYDROXY-5-BETA-CHOLAN-24-OIC-N-(PYRIDIN-4-YL)-AMIDE
SODIUM-CHEMODEOXYCHOLATE
5β-Cholanic acid-3α,7α-diol sodium salt
| Title | Journal or Book | Year |
|---|---|---|
| Bile acid–cysteamine conjugates: Structural properties, gelation, and toxicity evaluation | Steroids | 2012 |
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.