AESCULIN
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 5281417
Name
AESCULIN
Also reported as
AFZELIN; ESCULIN
IUPAC name
7-hydroxy-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-2H-chromen-2-one
SMILES
C1=CC(=O)OC2=CC(=C(C=C21)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O
Molecular formula
C15H16O9
Molecular weight
340.28 g/mol
Monoisotopic mass
340.0794 Da
Pathway:
Superclass:
Class:
Glycoside:
Yes
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Artemisia alba Turra | root | - |
Marco, J.A., Barbera, O., Sanchez-parareda, J. (1987). Flavonol and coumarin glycosides from Artemisia incanescens. J Nat Prod, 50(4), 774-775 doi:10.1021/np50052a045
|
| Artemisia vulgaris L. | - | - |
Bisset, N.G., ed. 1994. Herbal Drugs and Phytopharmaceuticals. CRC Press. Boca Raton, FL. 566 pp.
|
| Cichorium intybus L. | - | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Cichorium intybus L. | flower | - |
Rizk, A.F.M., The Phytochemistry of the Flora of Qatar, Scientific and Applied Research Centre, University of Qatar, Kingprint, Richmond, UK, 1986.
|
| Cichorium intybus L. | leaf | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Crataegus monogyna Jacq. | flower | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Epilobium hirsutum L. | - | - |
Barakat, H.H., Hussein, S.A.M., Marzour, M.S., Merfort, I., Linscheid, M., Nawwar, M.A.M. (1997). Polyphenolic metabolites of Epilobium hirsutum. Phytochemistry, 46(5), 935-941 doi:10.1016/s0031-9422(97)00370-1
|
| Fraxinus ornus L. subsp. ornus | bark | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|