(R)-Reticuline
Representations & DB's id
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| ChEBI: | CHEBI:17428 | |
|---|---|---|
| ChEMBL: | CHEMBL401501 | |
| PubChem: | 440586 | |
| IUPAC: | (1R)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol | |
| Standard InChI: | InChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-/m1/s1 | |
| Standard InChI Key: | BHLYRWXGMIUIHG-OAHLLOKOSA-N | |
| SMILES: | COc1ccc(cc1O)C[C@H]1N(C)CCc2c1cc(O)c(c2)OC | |
Molecular propeties
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| AlogP: | 2.89 | |
|---|---|---|
| Hydrogen bonds acceptors: | 5 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 3 | |
| Molecular Weight: | 329.16 | |
| Topological polar surface area: | 62.2 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.368 | |
| Number of carbons: | 19 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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