8-O-(7-TERT.-BUTOXYCARBONYLAMINOHEPTANOYL)-8-O-DEBUTANOYL-THAPSIGARGIN
Compound with spectra: 1 NMR
| SpectraBase Compound ID | FDlDwWbT1ha |
|---|---|
| InChI | InChI=1S/C42H65NO14/c1-11-13-14-15-18-22-30(46)53-34-32-31(26(4)33(34)54-36(47)25(3)12-2)35-42(51,41(10,50)37(48)55-35)28(24-40(32,9)56-27(5)44)52-29(45)21-19-16-17-20-23-43-38(49)57-39(6,7)8/h12,28,32-35,50-51H,11,13-24H2,1-10H3,(H,43,49)/b25-12-/t28-,32+,33-,34-,35-,40-,41+,42+/m0/s1 |
| InChIKey | XGYRUNFHSRJRJR-GZHGBNTOSA-N |
| Mol Weight | 808.0 g/mol |
| Molecular Formula | C42H65NO14 |
| Exact Mass | 807.440506 g/mol |
| Enantiomer InChIKey | XGYRUNFHSRJRJR-RZWPNYAYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Title | Journal or Book | Year |
|---|---|---|
| Design, Synthesis, and Pharmacological Evaluation of Thapsigargin Analogues for Targeting Apoptosis to Prostatic Cancer Cells | Journal of Medicinal Chemistry | 2001 |
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.