Peonidin
TL;DR: Peonidin (CAS 13491-25-3) is a chemical compound with molecular formula C16H13ClO6 and molecular weight 336.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-hydroxy-3-methoxyphenyl)chromenylium-3,5,7-triol chloride
Also Known As: Peonidin chloride, Peonidin, Paeonidin, Peonidin (chloride), YGM-6 (chloride)
| Molecular Formula | C16H13ClO6 |
|---|---|
| Molecular Weight | 336.04 g/mol |
| LogP | 0.2159 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.04007 |
| Heavy Atoms | 23 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 13491-25-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O.[Cl-] |
| InChIKey | OGBSHLKSHNAPEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Peonidin (CAS 13491-25-3), with molecular formula C16H13ClO6 and molecular weight 336.04 g/mol. IUPAC: 2-(4-hydroxy-3-methoxyphenyl)chromenylium-3,5,7-triol chloride.
Chemical Property Profile of Peonidin
Property Insights of Peonidin
The XLogP value of 0.2159 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Peonidin. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Peonidin. Following Lipinski's Rule of Five, Peonidin has 4 hydrogen bond donor(s) and 6 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 Peonidin?
The CAS number of Peonidin is 13491-25-3.
What is the molecular formula of Peonidin?
The molecular formula of Peonidin is C16H13ClO6.
What is the molecular weight of Peonidin?
The molecular weight of Peonidin is 336.04 g/mol.
Where can I buy Peonidin?
You can request a quote for Peonidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Peonidin?
Yes, KEHONG BIO provides custom synthesis services for Peonidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.