ETHYL-(1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLATE
Compound with spectra: 1 NMR
![ETHYL-(1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLATE](/api/compound/rAFiEK1vxh.png?ph=true&h=300&w=458 "ETHYL-(1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLATE")
| SpectraBase Compound ID | rAFiEK1vxh |
|---|---|
| InChI | InChI=1S/C27H28O12/c1-2-37-26(35)27(36)13-21(32)25(39-24(34)10-6-16-4-8-18(29)20(31)12-16)22(14-27)38-23(33)9-5-15-3-7-17(28)19(30)11-15/h3-12,21-22,25,28-32,36H,2,13-14H2,1H3/b9-5+,10-6+/t21-,22+,25-,27+/m1/s1 |
| InChIKey | RGAMPVVUXFUXES-XJORXMFWSA-N |
| Mol Weight | 544.51 g/mol |
| Molecular Formula | C27H28O12 |
| Exact Mass | 544.158076 g/mol |
| Enantiomer InChIKey | RGAMPVVUXFUXES-IOCPAQCDSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | ACETONE-D6 |
4,5-DI-O-CAFFEOYL-QUINIC-ACID-BUTYLESTER
3,4-DI-O-CAFFEOYL-QUINIC-ACID-METHYLESTER
4-O-FERULOYL-5-O-CAFFEOYLQUINIC-ACID
Methyl 3,4,5-tris(3',4'-dimethoxy-cinnamoyl)-quinate
METHYL_3,5-DI-O-CAFFEOYL-4-O-(3-HYDROXY-3-METHYL)-GLUTAROYLQUINATE
3,5-DI-O-CAFFEOLY-4-O-[(1-HYDROXY-4-OXOCYCLOHEXA-2,5-DIENYL)-ACETYL]-QUINIC_ACID
Cyclohexanecarboxylic acid, 3-[[3-(3,4-dimethoxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trimethoxy-, methyl ester, [1S-(1.alpha.,3.beta.,4.alpha.,5.alpha.)]-
1,3-DICAFFEOYL-EPI-QUINIC_ACID
1,5-DI-O-CAFFEOYL-QUINIC-ACID
CYNARIN
| Title | Journal or Book | Year |
|---|---|---|
| Cyclohexanecarboxylic-Acid Derivatives fromPsiadia trinervia | Helvetica Chimica Acta | 1992 |