Phyllodulcin
TL;DR: Phyllodulcin (CAS 480-46-6) is a chemical compound with molecular formula C16H14O5 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-8-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-3,4-dihydroisochromen-1-one
Also Known As: Phyllodulcin, d-Phyllodulcin, (+)-PHYLLODULCIN, 3R-phyllodulcin, (3R)-Phyllodulcin
| Molecular Formula | C16H14O5 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.08414 |
| Heavy Atoms | 21 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 480-46-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[C@H]2CC3=C(C(=CC=C3)O)C(=O)O2)O |
| InChIKey | PBILBHLAPJTJOT-CQSZACIVSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phyllodulcin (CAS 480-46-6), with molecular formula C16H14O5 and molecular weight 286.08 g/mol. IUPAC: (3R)-8-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-3,4-dihydroisochromen-1-one.
Chemical Property Profile of Phyllodulcin
Property Insights of Phyllodulcin
The XLogP value of 3.1 indicates that Phyllodulcin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phyllodulcin. Following Lipinski's Rule of Five, Phyllodulcin 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 Phyllodulcin?
The CAS number of Phyllodulcin is 480-46-6.
What is the molecular formula of Phyllodulcin?
The molecular formula of Phyllodulcin is C16H14O5.
What is the molecular weight of Phyllodulcin?
The molecular weight of Phyllodulcin is 286.08 g/mol.
Where can I buy Phyllodulcin?
You can request a quote for Phyllodulcin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phyllodulcin?
Yes, KEHONG BIO provides custom synthesis services for Phyllodulcin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.