TRANS-(+/-)-2-MERCAPTOMETHYL-4-(4-METHYLPHENYL)-4-OXOBUTANOIC-ACID-AMMONIUM-SALT;THIOLANE-FORM
Compound with spectra: 1 NMR
| SpectraBase Compound ID | GOhhqhpu9wU |
|---|---|
| InChI | InChI=1S/2C12H14O3S.2H3N/c2*1-8-2-4-10(5-3-8)12(15)6-9(7-16-12)11(13)14;;/h2*2-5,9,15H,6-7H2,1H3,(H,13,14);2*1H3/t2*9-,12-;;/m11../s1 |
| InChIKey | WQIAFARQVWKULL-FJICHWJOSA-N |
| Mol Weight | 502.6 g/mol |
| Molecular Formula | C24H26N2O6S2 |
| Exact Mass | 502.123229 g/mol |
| Parent InChIKey | IZSHELPBGNGSHX-BXKDBHETSA-N |
| Enantiomer InChIKey | WQIAFARQVWKULL-YCFPTELTSA-N |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
2R-(PARA-METHYLPHENYL)-6C-PHENYL-THIAN-4-ONE-1-OXIDE
2,5,5-trimethyl-2-(4-nitrophenyl)-1,3-oxathiane
1,3-Dithiane-2-propanoic acid, .beta.-methyl-2-phenyl-, ethyl ester, (.+-.)-
N-Benzyloxycarbonylglycyl-S-trityl-L-cysteine
3,3-Dimethyl-2-hydroxy-2-phenylthiomorpholine
2,2-Diphenylthiolane-3-carbonitrile
Methyl 2-(methoxycarbonyl)-4-methoxy-4-phenylhexanoate
3-Thiophenecarboxylic acid, 3-aminotetrahydro-2-phenyl-
1,5-Bis(4-tert-butylphenyl)-5-cyclopropyl-5-hydroxypentan-1-one
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis and Antirheumatic Activity of the Metabolites of Esonarimod | Bioorganic & Medicinal Chemistry | 2002 |