Berberine hydroxide
TL;DR: Berberine hydroxide (CAS 117-74-8) is a chemical compound with molecular formula C20H19NO5 and molecular weight 353.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16,17-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene hydroxide
Also Known As: Berberine hydroxide, Daru hald, Barberry root, Assam wood, Barberry extract
| Molecular Formula | C20H19NO5 |
|---|---|
| Molecular Weight | 353.13 g/mol |
| LogP | 2.92 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.1263 |
| Heavy Atoms | 26 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 117-74-8 |
|---|---|
| SMILES | COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[OH-] |
| InChIKey | GMMNRSJSVLUGRV-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Berberine hydroxide (CAS 117-74-8), with molecular formula C20H19NO5 and molecular weight 353.13 g/mol. IUPAC: 16,17-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene hydroxide.
Chemical Property Profile of Berberine hydroxide
Property Insights of Berberine hydroxide
The XLogP value of 2.92 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Berberine hydroxide. With a topological polar surface area (TPSA) of 41.8 Ų, Berberine hydroxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Berberine hydroxide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Berberine hydroxide?
The CAS number of Berberine hydroxide is 117-74-8.
What is the molecular formula of Berberine hydroxide?
The molecular formula of Berberine hydroxide is C20H19NO5.
What is the molecular weight of Berberine hydroxide?
The molecular weight of Berberine hydroxide is 353.13 g/mol.
Where can I buy Berberine hydroxide?
You can request a quote for Berberine hydroxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Berberine hydroxide?
Yes, KEHONG BIO provides custom synthesis services for Berberine hydroxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.