SECOLOGANIN
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 161276
Name
SECOLOGANIN
IUPAC name
methyl (2S,3R,4S)-4-(2-oxoethyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-vinyl-3,4-dihydro-2H-pyran-5-carboxylate
SMILES
COC(=O)C1=CO[C@H]([C@@H]([C@@H]1CC=O)C=C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
Molecular formula
C17H24O10
Molecular weight
388.37 g/mol
Monoisotopic mass
388.1369 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Cornus sanguinea L. subsp. hungarica (Kárpáti) Soó | leaf | - |
Bate-smith, E.C., Ferguson, I.K., Hutson, K., Jensen, S.R., Nielsen, B.J., Swain, T. (1975). Phytochemical interrelationships in the Cornaceae. Biochem Syst Ecol, 3, 79 doi:10.1016/0305-1978(75)90046-0
|
| Lonicera japonica Thunb. | flower | - |
Leung, A. Y. and Foster, S. 1995. Encyclopedia of Common Natural Ingredients 2nd Ed. John Wiley & Sons, New York. 649 pp.
|