3,5-DICAFFEOYL-QUINIC-ACID-METHYLESTER
Compound with spectra: 2 NMR
| SpectraBase Compound ID | C5SW94dL3YJ |
|---|---|
| InChI | InChI=1S/C26H26O12/c1-36-25(34)26(35)12-20(37-22(31)8-4-14-2-6-16(27)18(29)10-14)24(33)21(13-26)38-23(32)9-5-15-3-7-17(28)19(30)11-15/h2-11,20-21,24,27-30,33,35H,12-13H2,1H3/b8-4+,9-5+/t20-,21-,24-,26+/m1/s1 |
| InChIKey | VEBNYMXKXIIGFX-VOHNXBSUSA-N |
| Mol Weight | 530.48 g/mol |
| Molecular Formula | C26H26O12 |
| Exact Mass | 530.142426 g/mol |
| Enantiomer InChIKey | VEBNYMXKXIIGFX-DJJQSDKSSA-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. |
|---|
- 3,5-DI-O-CAFFEOYL-QUINIC-ACID-METHYLESTER
ETHYL-(1R,3R,4S,5R)-3,5-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,4-DIHYDROXYCYCLOHEXANECARBOXYLATE
Chlorogenic acid [3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid]
Chlorogenic acid, anion
3-BETA-O-TRANS-CAFFEOYL-1,4,5-TRIHYDROXYCYCLOHEXANE-1-CARBOXYLIC-ACID
3-CAFFEOYL-MUCO-QUINIC-ACID;1S-3-BETA-O-TRANS-CAFFEOYL-1-ALPHA,4-ALPHA,5-BETA-TRIHYDROXYCYCLOHEXANE-1-CARBOXYLIC-ACID
5-Caffeoylquinic acid
BENZYL-5-O-BUTANOYLQUINATE;BENZYL-5-BETA-(BUTANOYLOXY)-1-ALPHA,3-ALPHA,4-ALPHA-TRIHYDROXYCYCLOHEXANE-1-BETA-CARBOXYLATE
(1-alpha,3-beta,4-beta,5-beta)-1,4-Bis{[(2E)-3-(3,4-dihydroxyphenyl)-1-oxoprop-2-en-1-yl]oxy}-3,5-dihydroxycyclohexanecarboxylic Acid
2,4/3,5-DICAFFEOYL-GLUCARIC-ACID
| Title | Journal or Book | Year |
|---|---|---|
| Constituents from Lonicera japonica | Fitoterapia | 2000 |
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.