HuagongsheHuagongshe Chemistry Print Report · For research reference only
15-Hydroxy-6-en-dehydroabietic acid
Identifiers & Physical Properties
| CAS No. | 1186042-10-3 |
|---|---|
| Molecular formula | C20H26O3 |
| Average molar mass | 314.4 g/mol |
| Monoisotopic mass | 314.18819469 g/mol |
| SMILES | CC(C)(O)c1ccc2c(c1)C=C[C@H]1[C@](C)(C(=O)O)CCC[C@]21C |
| InChIKey | AXDUSIRSMKTCSD-NSISKUIASA-N |
| PubChem CID | 44479216 |
| DTXSID | DTXSID801292242 |
Chemical & Physical Properties
| XLogP | 3.9 |
|---|---|
| Topological polar surface area | 57.5 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 23 |
| Formal charge | 0 |
| Complexity | 523 |