METHYL-3-ALPHA-HYDROXY-5-BETA-CHOLAN-24-OATE
Compound with spectra: 4 NMR
| SpectraBase Compound ID | Ko4XituQo9u |
|---|---|
| InChI | InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1 |
| InChIKey | YXZVCZUDUJEPPK-ULCLHEGSSA-N |
| Mol Weight | 390.6 g/mol |
| Molecular Formula | C25H42O3 |
| Exact Mass | 390.313395 g/mol |
| Enantiomer InChIKey | YXZVCZUDUJEPPK-PMAAPSTLSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CH2Cl2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CH2Cl2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
- METHYL-LITHOCHOLATE
- 3-ALPHA-HYDROXY-5-BETA-CHOLSAEUREMETHYLESTER
3.alpha.-Hydroxy-5.beta.-cholan-24-oic acid ethylene glycol diester
3-Hydroxycholan-24-ohydrazide
3.beta.-Hydroxy-26,27-dimethyl-5.alpha.-cholestan-24-one
N-(1-propyl)lithocholylamide
2-[[(4R)-4-[(3R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-oxidanyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanoic acid
Glycolithocholic acid
N-(2-THIOETHYL)-3-ALPHA-HYDROXY-5-BETA-CHOLAN-24-AMIDE
| Title | Journal or Book | Year |
|---|---|---|
| Studies on the conformations in solution of 5β‐steroids having different side chains by 13C NMR spectroscopy | Magnetic Resonance in Chemistry | 1986 |
| Carbon‐13 NMR spectra of hydroxylated bile acid stereoisomers | Organic Magnetic Resonance | 1983 |
| 13C n.m.r. spectra of steroids —a survey and commentary | Organic Magnetic Resonance | 1977 |
| Nuclear magnetic resonance spectroscopy. Carbon-13 spectra of cholic acids and hydrocarbons included in sodium desoxycholate solutions | Journal of the American Chemical Society | 1973 |
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.
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.