Epiberberine
TL;DR: Epiberberine (CAS 105735-77-1) is a chemical compound with molecular formula C20H18NO4+ and molecular weight 336.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16,17-dimethoxy-5,7-dioxa-1-azoniapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaene
Also Known As: Epiberberine, dehydrocavidine, EPIBERBERINE ION, DEHYDROSINACTINE, EPIBERBERINE CATION
| Molecular Formula | C20H18NO4+ |
|---|---|
| Molecular Weight | 336.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 40.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.1236 |
| Heavy Atoms | 25 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 105735-77-1 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CC[N+]3=C2C=C4C=CC5=C(C4=C3)OCO5)OC |
| InChIKey | FPJQGFLUORYYPE-UHFFFAOYSA-N |
Product Overview
Epiberberine (CAS 105735-77-1), with molecular formula C20H18NO4+ and molecular weight 336.12 g/mol. IUPAC: 16,17-dimethoxy-5,7-dioxa-1-azoniapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),9,11,14,16,18-octaene.
Chemical Property Profile of Epiberberine
Property Insights of Epiberberine
The XLogP value of 3.6 indicates that Epiberberine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.8 Ų, Epiberberine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Epiberberine has 0 hydrogen bond donor(s) and 4 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 Epiberberine?
The CAS number of Epiberberine is 105735-77-1.
What is the molecular formula of Epiberberine?
The molecular formula of Epiberberine is C20H18NO4+.
What is the molecular weight of Epiberberine?
The molecular weight of Epiberberine is 336.12 g/mol.
Where can I buy Epiberberine?
You can request a quote for Epiberberine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epiberberine?
Yes, KEHONG BIO provides custom synthesis services for Epiberberine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.