NEO-CHLOROGENIC-ACID
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5280633
Name
NEO-CHLOROGENIC-ACID
Also reported as
NEOCLOROGENIC-ACID; TRANS-NEOCHLOROGENIC-ACID
IUPAC name
(1R,3R,4S,5R)-3-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,4,5-trihydroxycyclohexane-1-carboxylic acid
SMILES
C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O
Molecular formula
C16H18O9
Molecular weight
354.31 g/mol
Monoisotopic mass
354.0951 Da
Pathway:
Superclass:
Class:
Glycoside:
No
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Betonica officinalis L. | - | - |
CRC Handbook of Medicinal Herbs and/or CRC Handbook of Proximate Analyses
|
| Betonica officinalis L. | aerial parts | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Cichorium intybus L. | aerial parts | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Cichorium intybus L. | root | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Humulus lupulus L. | fruit | - |
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
|
| Juglans regia L. | leaf | - |
Bisset, N.G., ed. 1994. Herbal Drugs and Phytopharmaceuticals. CRC Press. Boca Raton, FL. 566 pp.
|
| Laserpitium latifolium L. | leaf | - |
Vereskovskii, V.V., Kuznetsova, Z.P., Loznukho, I.V., Sokolov, I.V., Osokin, D.M. (1993). Phenolic compounds of Laserpitium latifolium. Chem Nat Comp, 28(6), 631-632 doi:10.1007/bf00630451
|
| Matricaria chamomilla L. | flower | - |
Mulinacci, N., Romani, A., Pinelli, P., Vincieri, F.F., Prucher, D. (2000). Characterization of Matricaria recutita L. flower extracts by hplc-ms and hplc-dad analysis. Chromatographia, 51(5/6), 301-307 doi:10.1007/bf02490607
|
| Plantago lanceolata L. | leaf | - |
Maksyutina, N.P. (1971). Hydroxycinnamic acids from Plantago major and Plantago lanceolata. Khim Prir Soedin, 7(6), 824-825 doi:10.1007/bf00567943
|
| Plantago major L. | leaf | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Pyrus communis L. subsp. pyraster (L.) Ehrh. | - | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Vaccinium myrtillus L. | fruit | 10 ppm |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Vaccinium myrtillus L. | leaf | 140 ppm |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|