For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3,5-DICAFFEOYL-QUINIC-ACID

Compound with spectra: 5 NMR

3,5-DICAFFEOYL-QUINIC-ACID
SpectraBase Compound ID AjIbU1C3pEZ
InChI InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(30)36-19-11-25(35,24(33)34)12-20(23(19)32)37-22(31)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-29,32,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23-,25+/m0/s1
InChIKey KRZBCHWVBQOTNZ-ZSGFIFMUSA-N
Mol Weight 516.46 g/mol
Molecular Formula C25H24O12
Exact Mass 516.126776 g/mol
Enantiomer InChIKey KRZBCHWVBQOTNZ-PSEXTPKNSA-N

View Spectrum of 3,5-DICAFFEOYL-QUINIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6

View Spectrum of 3,5-DICAFFEOYL-QUINIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

View Spectrum of 3,5-DICAFFEOYL-QUINIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

View Spectrum of 3,5-DICAFFEOYL-QUINIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD

View Spectrum of 3,5-DICAFFEOYL-QUINIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
  • 3,5-O-DICAFFEOYLQUINIC-ACID
  • 3,5-DI-O-CAFFEOYLQUINIC-ACID
3,5-DICAFFEOYL-EPI-QUINIC_ACID
ETHYL-(1R,3R,4S,5R)-3,5-BIS-([(E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-OXY)-1,4-DIHYDROXYCYCLOHEXANECARBOXYLIC-ACID
3,5-O-DICAFFEOYLQUINIC-ACID
3,5-DICAFFEOYLQUINIC_ACID;(1-S,3-R,4-S,5-S)-1,3-BIS-({[(2-E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-
HYMENOSIDE-P
DRACUNCULIFOSIDE-E
1-O-BENZYL-6-O-(E)-CAFFEOYL-BETA-D-GLUCOPYRANOSIDE
2-(4-HYDROXYPHENYL)-EHTYL-(6-O-CAFFEOYL)-BETA-D-GLUCOPYRANOSIDE
7-CAFFEOYLSEDOHEPTULOSE
3,4-DIMETHOXY-TRANS-CINNAMIC-ACID-9-O-BETA-D-ALLOPYRANOSIDE
SINAPOYLGLUCOSE
NINGPOSIDE-C;3-O-ACETYL-2-O-PARA-HYDROXYCINNAMOYL-ALPHA-L-RHAMNOPYRANOSIDE
Title Journal or Book Year
Irbic acid, a dicaffeoylquinic acid derivative from Centella asiatica cell cultures Fitoterapia 2011
Major dicaffeoylquinic acids from Artemisia vulgaris Fitoterapia 2000
Constituents from Lonicera japonica Fitoterapia 2000
3,5-Di-O-caffeoylquinic acid, an infection-inhibiting factor from Pyrus pyrifolia induced by infection with Alternaria alternata Phytochemistry 1998

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.

3,5-O-DICAFFEOYLQUINIC-ACID
3,5-DICAFFEOYLQUINIC_ACID;(1-S,3-R,4-S,5-S)-1,3-BIS-({[(2-E)-3-(3,4-DIHYDROXYPHENYL)-PROP-2-ENOYL]-
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.