Alpha-Humulone
Representations & DB's id
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| ChEBI: | CHEBI:5768 | |
|---|---|---|
| ChEMBL: | CHEMBL251280 | |
| PubChem: | 5281520 | |
| IUPAC: | (1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene | |
| Standard InChI: | InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7+,14-10+ | |
| Standard InChI Key: | FAMPSKZZVDUYOS-HRGUGZIWSA-N | |
| SMILES: | C/C/1=CCC(C)(C)/C=C/C/C(=C/CC1)/C | |
Molecular propeties
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| AlogP: | 5.04 | |
|---|---|---|
| Hydrogen bonds acceptors: | 0 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 1 | |
| Molecular Weight: | 204.19 | |
| Topological polar surface area: | 0 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.6 | |
| Number of carbons: | 15 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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