BUDDLEJOSIDE A
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 102071173
Name
BUDDLEJOSIDE A
IUPAC name
((1S,4aR,5S,7aS)-5-hydroxy-1-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl)methyl 4-hydroxybenzoate
SMILES
C1=CO[C@H]([C@H]2[C@@H]1[C@@H](C=C2COC(=O)C3=CC=C(C=C3)O)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O
Molecular formula
C22H26O11
Molecular weight
466.44 g/mol
Monoisotopic mass
466.1475 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Scrophularia nodosa L. | aerial parts | - |
Miyase, T., Mimatsu, A. (1999). Acylated iridoid and phenylethanoid glyucosides from the aerial parts of Scrophularia nodosa. J Nat Prod, 62(8), 1079-10184 doi:10.1021/np9805746
|