ISOADHUMULONE
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Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 58473847
Name
ISOADHUMULONE
IUPAC name
(4S,5S)-3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)-2-(2-methylbutanoyl)-4-(4-methylpent-3-enoyl)cyclopent-2-en-1-one
SMILES
CCC(C)C(=O)C1=C([C@@]([C@@H](C1=O)CC=C(C)C)(C(=O)CC=C(C)C)O)O
Molecular formula
C21H30O5
Molecular weight
362.47 g/mol
Monoisotopic mass
362.2093 Da
Pathway:
Superclass:
Class:
Glycoside:
No
Chemical classification: NPClassifier (Kim et al., 2021)
| Plant | Plant part | Amount | Reference |
|---|---|---|---|
| Humulus lupulus L. | fruit | - |
List, P.H. and Horhammer, L., Hager's Handbuch der Pharmazeutischen Praxis, Vols. 2-6, Springer-Verlag, Berlin, 1969-1979.
|