BETULINIC-ACID-3-BETA-CAFFEATE
Compound with spectra: 3 NMR
| SpectraBase Compound ID | AwooFHFs50b |
|---|---|
| InChI | InChI=1S/C39H54O6/c1-23(2)25-14-19-39(34(43)44)21-20-37(6)26(33(25)39)10-12-30-36(5)17-16-31(35(3,4)29(36)15-18-38(30,37)7)45-32(42)13-9-24-8-11-27(40)28(41)22-24/h8-9,11,13,22,25-26,29-31,33,40-41H,1,10,12,14-21H2,2-7H3,(H,43,44)/b13-9+/t25-,26+,29-,30+,31-,33+,36-,37+,38+,39-/m0/s1 |
| InChIKey | MNUNUJQYFJZRHQ-VZLLCJDWSA-N |
| Mol Weight | 618.9 g/mol |
| Molecular Formula | C39H54O6 |
| Exact Mass | 618.392039 g/mol |
| Enantiomer InChIKey | MNUNUJQYFJZRHQ-CJLFXVPHSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | C5D5N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | ACETONE-D6 |
- 3-O-(3',4'-DIHYDROXYCINNAMOYL)-BETULINIC-ACID;PYRACRENIC-ACID
- LUP-20(29)-EN-28-OIC-3-BETA-YL-CAFFEATE;BETULINIC-ACID-3-BETA-YL-CAFFEATE
| Title | Journal or Book | Year |
|---|---|---|
| Triterpene caffeoyl esters and diterpenes from Celastrus stephanotifolius | Phytochemistry | 1999 |
| Triterpene caffeates from bark of Betula pubescens | Phytochemistry | 1994 |
| Lupane Triterpenoids of Salacia cordata | Journal of Natural Products | 1992 |
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.