BETA-ECDYSTERONE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 101778163
Name
BETA-ECDYSTERONE
Also reported as
ECDYSTERONE
IUPAC name
(2S,3R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-17-((2S,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl)-1,2,3,4,5,9,10,11,12,13,14,15,16,17-tetradecahydro-6H-cyclopenta[a]phenanthren-6-one
SMILES
C[C@]12CC[C@H]3C(=CC(=O)C4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)[C@@]1(CC[C@@H]2[C@@](C)([C@@H](CCC(C)(C)O)O)O)O
Molecular formula
C27H44O7
Molecular weight
480.64 g/mol
Monoisotopic mass
480.3087 Da
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Chenopodium album L. subsp. album | root | - |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|
| Morus alba L. | leaf | 1 ppm |
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
|