Berberine sulfate anhydrous
TL;DR: Berberine sulfate anhydrous (CAS 316-41-6) is a chemical compound with molecular formula C40H36N2O12S and molecular weight 768.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(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);sulfate
Also Known As: Berberine sulphate, BERBERINE SULFATE, Berberin sulfate, Berberal, Erben
| Molecular Formula | C40H36N2O12S |
|---|---|
| Molecular Weight | 768.20 g/mol |
| LogP | 4.85 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 768.1989 |
| Heavy Atoms | 55 |
| Complexity | 551.0 |
| Solubility | INSOL IN CHLOROFORM /TRIHYDRATE/ |
Chemical Identifiers
| CAS Number | 316-41-6 |
|---|---|
| SMILES | COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[O-]S(=O)(=O)[O-] |
| InChIKey | OJVABJMSSDUECT-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Berberine sulfate anhydrous (CAS 316-41-6), with molecular formula C40H36N2O12S and molecular weight 768.20 g/mol. IUPAC: bis(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);sulfate.
Chemical Property Profile of Berberine sulfate anhydrous
Property Insights of Berberine sulfate anhydrous
The XLogP value of 4.85 indicates that Berberine sulfate anhydrous is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 170.0 Ų indicates high polarity, suggesting Berberine sulfate anhydrous may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Berberine sulfate anhydrous has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Berberine sulfate anhydrous?
The CAS number of Berberine sulfate anhydrous is 316-41-6.
What is the molecular formula of Berberine sulfate anhydrous?
The molecular formula of Berberine sulfate anhydrous is C40H36N2O12S.
What is the molecular weight of Berberine sulfate anhydrous?
The molecular weight of Berberine sulfate anhydrous is 768.20 g/mol.
Where can I buy Berberine sulfate anhydrous?
You can request a quote for Berberine sulfate anhydrous directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Berberine sulfate anhydrous?
Yes, KEHONG BIO provides custom synthesis services for Berberine sulfate anhydrous and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.