7,12-DIHYDROXY-METHYL-5-BETA-CHOL-3-ENOATE
Compound with spectra: 2 NMR, and 1 MS (GC)
| SpectraBase Compound ID | DIsOJHl5Ctq |
|---|---|
| InChI | InChI=1S/C25H40O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h5,7,15-21,23,26-27H,6,8-14H2,1-4H3/t15-,16+,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1 |
| InChIKey | UYNYCDBHORSDKX-KGFCUSQPSA-N |
| Mol Weight | 404.6 g/mol |
| Molecular Formula | C25H40O4 |
| Exact Mass | 404.29266 g/mol |
| Enantiomer InChIKey | UYNYCDBHORSDKX-WAMADIAFSA-N |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | T. Iida, Nihon University, Fukushima, Japan J. Goto and T. Nambara, Tohoku University, Sendai, Japan Magn. Reson. Chem. 31, 421(1993) |
| Solvent | Chloroform-d; Reference=TMS; Temperature=25C Spectrometer= Jeol FX-90Q |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | APC-314-125-12 |
- 7α,12α-dihydroxy-5β-chol-3-en-24-oic acid, methyl ester
- 5beta-CHOL-3-EN-24-OIC ACID, 7alpha,12alpha-DIHYDROXY-, METHYL ESTER
- 7alpha,12alpha-Dihydroxy-5beta-chol-3-enoic acid-methylester
(4R)-4-[(5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester
5.alpha.-Cholan-24-oic acid, 7.alpha.,12.alpha.-dihydroxy-3-oxo-, methyl ester
Methyl 3-carbethoxy-7.alpha.,12.alpha.-dihydroxy-5.beta.-cholan-24-oate
CHAPSO
Methyl ester of (3.alpha.,5.beta.,7.alpha.,12.alpha.)-7,12-dihydroxy-3-(nitrooxy)cholan-24-oic acid
Propyl 3.alpha.-acetoxy-7.alpha.,12.alpha.-dihydroxy-5.beta.-cholanate
METHYL-3-ALPHA-ACETYLOXY-7-ALPHA,12-ALPHA-HYDROXY-5-BETA-CHOLAN-24-OATE
3A-ACETYLOXY-7A,12A-DIHYDROXY-5B-CHOLAN-24-OATE
Ethyl 3.alpha.-acetoxy-7.alpha.,12.alpha.-dihydroxy-5.beta.-cholanate
Cholan-24-oic acid, 7,12-dihydroxy-3-(1-oxopropoxy)-, methyl ester, (3.alpha.,5.beta.,7.alpha.,12.alpha.)-
| Title | Journal or Book | Year |
|---|---|---|
| Carbon-13 NMR spectra of bile acid derivatives. Part III. Unsaturated 5β-cholanoic acids | Magnetic Resonance in Chemistry | 1993 |
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