TL;DR: 2,3,9,10-Tetrahydroxyberberine (CAS 162854-37-7) is a chemical compound with molecular formula C17H14NO4+ and molecular weight 296.0923 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3,9,10-tetrol
Also Known As: 2,3,9,10-Tetrahydroxyberberine, 5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2,3,9,10-tetrol, 2,3,9,10-Tetrahydroxy-5,6-dihydroisoquinolino[3,2-a]isoquinolin-7-ium, (3,10,11-trihydroxy-7,8-dihydro-6-azatetraphen-4-ylidene)oxidanium, 2,3,9,10-Tetrahydroxy-5,6-dihydro-isoquino[3,2-a]isoquinolinylium chloride
| Molecular Formula | C17H14NO4+ |
| Molecular Weight | 296.0923 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 84.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 296.0923 Da |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
| SMILES | C1C[N+]2=C(C=C3C=CC(=C(C3=C2)O)O)C4=CC(=C(C=C41)O)O |
| InChIKey | DAHMYCXNJSCLGA-UHFFFAOYSA-O |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,9,10-Tetrahydroxyberberine. The TPSA of 84.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,9,10-Tetrahydroxyberberine. Following Lipinski's Rule of Five, 2,3,9,10-Tetrahydroxyberberine has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3,9,10-Tetrahydroxyberberine is 162854-37-7.
The molecular formula of 2,3,9,10-Tetrahydroxyberberine is C17H14NO4+.
The molecular weight of 2,3,9,10-Tetrahydroxyberberine is 296.0923 g/mol.
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