MEDICAGENIC-ACID-3-BETA-O-BETA-MALTOSIDE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 162869988
Name
MEDICAGENIC-ACID-3-BETA-O-BETA-MALTOSIDE
IUPAC name
(2S,3R,4S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-3-(((2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-2-hydroxy-4,6a,6b,11,11,14b-hexamethyl-2,3,4,4a,5,6,6a,6b,7,8,9,10,11,12,12a,14,14a,14b-octadecahydropicene-4,8a(1H)-dicarboxylic acid
SMILES
C[C@@]12CC[C@@H]5[C@@]([C@H]1CC=C3[C@]2(CC[C@@]4([C@H]3CC(CC4)(C)C)C(=O)O)C)(C[C@@H]([C@@H]([C@@]5(C)C(=O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)O[C@@H]7[C@@H]([C@H]([C@@H]([C@@H](CO)O7)O)O)O)O)O)O)C
Molecular formula
C42H66O16
Molecular weight
826.97 g/mol
Monoisotopic mass
826.4351 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Medicago sativa L. | root | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|