7-ALPHA-HYDROXYDAUCOSTEROL
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 13193018
Name
7-ALPHA-HYDROXYDAUCOSTEROL
IUPAC name
(2R,3R,4S,5S,6R)-2-(((3S,7S,8S,9S,10R,13R,14S,17R)-17-((2R,5R)-5-ethyl-6-methylheptan-2-yl)-7-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
SMILES
CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C=C4[C@@]3(CC[C@@H](C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)O)C)C(C)C
Molecular formula
C35H60O7
Molecular weight
592.86 g/mol
Monoisotopic mass
592.4339 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Urtica dioica L. | root | 2 ppm |
Jim Duke's personal files.
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