Beta-Pinene
Representations & DB's id
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| ChEBI: | CHEBI:50025 | |
|---|---|---|
| ChEMBL: | CHEMBL501351 | |
| PubChem: | 14896 | |
| IUPAC: | 6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane | |
| Standard InChI: | InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3 | |
| Standard InChI Key: | WTARULDDTDQWMU-UHFFFAOYSA-N | |
| SMILES: | C=C1CCC2CC1C2(C)C | |
Molecular propeties
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| AlogP: | 3 | |
|---|---|---|
| Hydrogen bonds acceptors: | 0 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 136.13 | |
| Topological polar surface area: | 0 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.8 | |
| Number of carbons: | 10 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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