TIRUCALL-5-EN-3-BETA-OL
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Name
TIRUCALL-5-EN-3-BETA-OL
IUPAC name
(3S,9S,10R,13S,14R,17S)-4,4,10,13,14-pentamethyl-17-((S)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
SMILES
C[C@@H](CCCC(C)C)[C@@H]1CC[C@]2([C@]1(CC[C@H]3C2CC=C4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C
Molecular formula
C30H52O
Molecular weight
428.75 g/mol
Monoisotopic mass
428.4018 Da
Pathway:
Superclass:
Class:
Glycoside:
No
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Bryonia dioica Jacq. | root | - |
Akihisa, T., Kimura, Y., Kokke, W.C.M.C., Itoh, T., Tamura, T. (1996). Eight novel sterols from the roots of Bryonia dioica jacq. Chem Pharm Bull, 44(6), 1202-1207 doi:10.1248/cpb.44.1202
|