Isodrimeninol
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL459607 | |
| PubChem: | 11322321 | |
| IUPAC: | (1R,5aS,9aS,9bR)-6,6,9a-trimethyl-1,3,5,5a,7,8,9,9b-octahydrobenzo[g][2]benzofuran-1-ol | |
| Standard InChI: | InChI=1S/C15H24O2/c1-14(2)7-4-8-15(3)11(14)6-5-10-9-17-13(16)12(10)15/h5,11-13,16H,4,6-9H2,1-3H3/t11-,12+,13+,15-/m0/s1 | |
| Standard InChI Key: | FCSNZJLUQLZSBW-JLNYLFASSA-N | |
| SMILES: | O[C@@H]1OCC2=CC[C@@H]3[C@]([C@@H]12)(C)CCCC3(C)C | |
Molecular propeties
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| AlogP: | 3.11 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 236.18 | |
| Topological polar surface area: | 29.5 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.867 | |
| Number of carbons: | 15 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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