(+/-)-3''-Hydroxy-Delta(4'',5'')-Cannabichromene
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL558682 | |
| PubChem: | 44139613 | |
| IUPAC: | 2-(3-hydroxy-4-methylpent-4-enyl)-2-methyl-7-pentylchromen-5-ol | |
| Standard InChI: | InChI=1S/C21H30O3/c1-5-6-7-8-16-13-19(23)17-9-11-21(4,24-20(17)14-16)12-10-18(22)15(2)3/h9,11,13-14,18,22-23H,2,5-8,10,12H2,1,3-4H3 | |
| Standard InChI Key: | IDJFUDPWCZNLTI-UHFFFAOYSA-N | |
| SMILES: | CCCCCc1cc2OC(C)(CCC(C(=C)C)O)C=Cc2c(c1)O | |
Molecular propeties
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| AlogP: | 5.01 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 8 | |
| Number of rings: | 2 | |
| Molecular Weight: | 330.22 | |
| Topological polar surface area: | 49.7 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.524 | |
| Number of carbons: | 21 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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