Berberine acetonic
TL;DR: Berberine acetonic (CAS 632-47-3) is a chemical compound with molecular formula C19H20ClNO4 and molecular weight 361.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(12S)-17-methoxy-11-methyl-3,5-dioxa-11-azoniapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-18-ol chloride
Also Known As: Berberine acetonic, Bulbocapnine hydrochloride, BULBOCAPNINE HCl, 10-Methoxy-1,2-(methylenedioxy)-6a-alpha-aporphin-11-ol hydrochloride, 6a-alpha-APORPHIN-11-OL, 10-METHOXY-1,2-(METHYLENEDIOXY)-, HYDROCHLORIDE
| Molecular Formula | C19H20ClNO4 |
|---|---|
| Molecular Weight | 361.11 g/mol |
| LogP | -1.53 |
| Topological Polar Surface Area | 52.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 361.1081 |
| Heavy Atoms | 25 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 632-47-3 |
|---|---|
| SMILES | C[NH+]1CCC2=CC3=C(C4=C2[C@@H]1CC5=C4C(=C(C=C5)OC)O)OCO3.[Cl-] |
| InChIKey | SRGIVPUDHITDMK-YDALLXLXSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Berberine acetonic (CAS 632-47-3), with molecular formula C19H20ClNO4 and molecular weight 361.11 g/mol. IUPAC: (12S)-17-methoxy-11-methyl-3,5-dioxa-11-azoniapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-18-ol chloride.
Chemical Property Profile of Berberine acetonic
Property Insights of Berberine acetonic
The XLogP value of -1.53 indicates that Berberine acetonic is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.4 Ų, Berberine acetonic exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Berberine acetonic has 2 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 acetonic?
The CAS number of Berberine acetonic is 632-47-3.
What is the molecular formula of Berberine acetonic?
The molecular formula of Berberine acetonic is C19H20ClNO4.
What is the molecular weight of Berberine acetonic?
The molecular weight of Berberine acetonic is 361.11 g/mol.
Where can I buy Berberine acetonic?
You can request a quote for Berberine acetonic directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Berberine acetonic?
Yes, KEHONG BIO provides custom synthesis services for Berberine acetonic and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.