Hydrocodone
Representations & DB's id
| ||
| ChEBI: | CHEBI:5779 | |
|---|---|---|
| ChEMBL: | CHEMBL1457 | |
| PubChem: | 5284569 | |
| IUPAC: | (4R,4aR,7aR,12bS)-9-methoxy-3-methyl-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one | |
| Standard InChI: | InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-12,17H,4-5,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1 | |
| Standard InChI Key: | LLPOLZWFYMWNKH-CMKMFDCUSA-N | |
| SMILES: | COc1ccc2c3c1O[C@@H]1[C@@]43CCN([C@H](C2)[C@@H]4CCC1=O)C | |
Molecular propeties
| ||
| AlogP: | 1.93 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 5 | |
| Molecular Weight: | 299.15 | |
| Topological polar surface area: | 38.8 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.611 | |
| Number of carbons: | 18 | |