Oxyberberine
TL;DR: Oxyberberine (CAS 549-21-3) is a chemical compound with molecular formula C20H17NO5 and molecular weight 351.1107 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaen-14-one
Also Known As: Oxyberberine, Berlambine, 8-Oxyberberine, Oxyberberin, Ketoberberine
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H17NO5 |
| Molecular Weight | 351.1107 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 57.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.1107 Da |
| Heavy Atoms | 26 |
| Complexity | 607.0 |
| SMILES | COC1=C(C2=C(C=C1)C=C3C4=CC5=C(C=C4CCN3C2=O)OCO5)OC |
| InChIKey | ZHYQCBCBTQWPLC-UHFFFAOYSA-N |
Product Description
Applications: Oxyberberine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oxyberberine (CAS 549-21-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Oxyberberine is a pharmaceutical intermediate identified by CAS number 549-21-3 and the molecular formula C20H17NO5 and a molecular weight of 351.11 g/mol. It is also known as Oxyberberine and Berlambine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Oxyberberine
Property Insights of Oxyberberine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxyberberine. With a topological polar surface area (TPSA) of 57.2 Ų, Oxyberberine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxyberberine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Oxyberberine?
The CAS number of Oxyberberine is 549-21-3.
What is the molecular formula of Oxyberberine?
The molecular formula of Oxyberberine is C20H17NO5.
What is the molecular weight of Oxyberberine?
The molecular weight of Oxyberberine is 351.1107 g/mol.
What are the applications of Oxyberberine?
Oxyberberine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Oxyberberine (CAS 549-21-3) with custom...
Where can I buy Oxyberberine?
You can request a quote for Oxyberberine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Oxyberberine?
Yes, CoreyChem provides custom synthesis services for Oxyberberine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.