Panduratin A
TL;DR: Panduratin A (CAS 89837-52-5) is a chemical compound with molecular formula C26H30O4 and molecular weight 406.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dihydroxy-4-methoxyphenyl)-[(1R,2S,6R)-3-methyl-2-(3-methylbut-2-enyl)-6-phenylcyclohex-3-en-1-yl]methanone
Also Known As: Panduratin A, Panoid, Panduratin, Panduratin N, Panduratin O
| Molecular Formula | C26H30O4 |
|---|---|
| Molecular Weight | 406.21 g/mol |
| LogP | 6.0116 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.21442 |
| Heavy Atoms | 30 |
| Complexity | 944.77814 |
Chemical Identifiers
| CAS Number | 89837-52-5 |
|---|---|
| SMILES | CC1=CC[C@H]([C@@H]([C@@H]1CC=C(C)C)C(=O)C2=C(C=C(C=C2O)OC)O)C3=CC=CC=C3 |
Product Overview
Panduratin A (CAS 89837-52-5), with molecular formula C26H30O4 and molecular weight 406.21 g/mol. IUPAC: (2,6-dihydroxy-4-methoxyphenyl)-[(1R,2S,6R)-3-methyl-2-(3-methylbut-2-enyl)-6-phenylcyclohex-3-en-1-yl]methanone.
Chemical Property Profile of Panduratin A
Property Insights of Panduratin A
The XLogP value of 6.0116 indicates that Panduratin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Panduratin A. Following Lipinski's Rule of Five, Panduratin A has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Panduratin A?
The CAS number of Panduratin A is 89837-52-5.
What is the molecular formula of Panduratin A?
The molecular formula of Panduratin A is C26H30O4.
What is the molecular weight of Panduratin A?
The molecular weight of Panduratin A is 406.21 g/mol.
Where can I buy Panduratin A?
You can request a quote for Panduratin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Panduratin A?
Yes, KEHONG BIO provides custom synthesis services for Panduratin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.