(22E)-3-ALPHA,6-ALPHA,7-ALPHA,12-ALPHA-TETRAHYDROXY-5-BETA-CHOL-22-EN-24-OYL-GLYCINE-SODIUM-SALT
Compound with spectra: 1 NMR
| SpectraBase Compound ID | AST0U5tGLmr |
|---|---|
| InChI | InChI=1S/C26H41NO7.Na/c1-13(4-7-20(30)27-12-21(31)32)15-5-6-16-22-17(11-19(29)26(15,16)3)25(2)9-8-14(28)10-18(25)23(33)24(22)34;/h4,7,13-19,22-24,28-29,33-34H,5-6,8-12H2,1-3H3,(H,27,30)(H,31,32);/q;+1/p-1/b7-4+;/t13-,14-,15-,16+,17+,18+,19+,22+,23-,24+,25-,26-;/m1./s1 |
| InChIKey | JANLUTBVVBAODV-BLXGVYCNSA-M |
| Mol Weight | 501.6 g/mol |
| Molecular Formula | C26H40NNaO7 |
| Exact Mass | 501.270247 g/mol |
| Parent InChIKey | SYXJZJVISIIELS-LUOUPTLDSA-M |
| Enantiomer InChIKey | JANLUTBVVBAODV-WCLDBWIESA-M |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
(22E)-3-ALPHA,6-ALPHA,7-ALPHA,12-ALPHA-TETRAHYDROXY-5-BETA-CHOL-22-EN-24-OYL-TAURINE-SODIUM-SALT
(22E)-3-ALPHA,6-ALPHA,7-ALPHA,12-ALPHA-TETRAHYDROXY-5-BETA-CHOL-22-EN-24-OIC-ACID
METHYL-3-ALPHA,6-BETA,7-BETA,12-ALPHA-TETRAHYDROXY-5-ALPHA-CHOLANOATE
3A,6A,7A,12A-TETRAHYDROXY-5B-CHOLANOIC ACID METHYL ESTER
METHYL-3-ALPHA,6-BETA,7-ALPHA,12-ALPHA-TETRAHYDROXY-5-BETA-CHOLANOATE
METHYL-3-ALPHA,6-BETA,7-BETA,12-ALPHA-TETRAHYDROXY-5-BETA-CHOLANOATE
3A,6B,7A,12A-TETRAHYDROXY-5B-CHOLANOIC ACID METHYL ESTER
3A,6A,7B,12A-TETRAHYDROXY-5A-CHOLANOIC ACID METHYL ESTER
METHYL-3-ALPHA,6-ALPHA,7-BETA,12-ALPHA-TETRAHYDROXY-5-ALPHA-CHOLANOATE
3A,6B,7B,12A-TETRAHYDROXY-5A-CHOLANOIC ACID METHYL ESTER
| Title | Journal or Book | Year |
|---|---|---|
| Chemical Synthesis of (22E)-3.ALPHA.,6.ALPHA.,7.ALPHA.,12.ALPHA.-Tetrahydroxy-5.BETA.-chol-22-en-24-oic Acid and Its N-Acylamidated Conjugates with Glycine or Taurine: Precursors of the [22,23-3H] Labelled Tracers | Chemical and Pharmaceutical Bulletin | 2010 |
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.