8-Hydroxydihydrosanguinarine
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1921809 | |
| PubChem: | 14313843 | |
| IUPAC: | 24-methyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(13),2,4(8),9,11,14(22),15,17(21)-octaen-23-ol | |
| Standard InChI: | InChI=1S/C20H15NO5/c1-21-18-12(3-2-10-6-15-16(7-13(10)18)25-8-24-15)11-4-5-14-19(26-9-23-14)17(11)20(21)22/h2-7,20,22H,8-9H2,1H3 | |
| Standard InChI Key: | YZRQUTZNTDAYPJ-UHFFFAOYSA-N | |
| SMILES: | OC1c2c3OCOc3ccc2c2c(N1C)c1cc3OCOc3cc1cc2 | |
Molecular propeties
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| AlogP: | 3.4 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 6 | |
| Molecular Weight: | 349.1 | |
| Topological polar surface area: | 60.4 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.2 | |
| Number of carbons: | 20 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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