1,3,5-TRI-O-CAFFEOYL-QUINIC-ACID
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 8hvCiSpWdAH |
|---|---|
| InChI | InChI=1S/C34H30O15/c35-21-7-1-18(13-24(21)38)4-10-29(41)47-27-16-34(33(45)46,49-31(43)12-6-20-3-9-23(37)26(40)15-20)17-28(32(27)44)48-30(42)11-5-19-2-8-22(36)25(39)14-19/h1-15,27-28,32,35-40,44H,16-17H2,(H,45,46)/b10-4+,11-5+,12-6+/t27-,28-,32-,34+/m0/s1 |
| InChIKey | MSKVJEAKVWAQTA-PTQGEPLWSA-N |
| Mol Weight | 678.6 g/mol |
| Molecular Formula | C34H30O15 |
| Exact Mass | 678.15847 g/mol |
| Enantiomer InChIKey | MSKVJEAKVWAQTA-YOWOTECTSA-N |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CD3OD |
1-ISOBUTYRYL-3,5-DICAFFEOYLQUINIC-ACID
IRBIC-ACID;3,5-DICAFFEOYL-4-O-MALONYLQUINIC-ACID
(1S,3R,4S,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID
(1S,3R,4R,5R)-3,4-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,5-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID
3-O-[3,4-(DIMETHOXY)-CINNAMOYL]-1,5-GAMMA-QUINIDE
2-Nitrochlorogenic acid
3,4,5-TRI-O-GALLOYLQUINIC-ACID
BREVIPOLIDE_E
1-O-CAFFEOYL-BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
DUNALIANOSIDE-E;4'-O-ACETYL-6'-O-TRANS-CAFFEOYL-BETA-D-GLUCOPYRANOSIDE
| Title | Journal or Book | Year |
|---|---|---|
| 1,3,5-Tri-O-caffeoylquinic acid from Xanthium strumarium | Phytochemistry | 1993 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
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