(Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate
TL;DR: (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate (CAS 7801-91-4) is a chemical compound with molecular formula C22H26O12 and molecular weight 482.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxybenzoate
Also Known As: Catalposide, Catalpin, Hydroxybenzoyl catalpol, EINECS 229-789-1, (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate
| Molecular Formula | C22H26O12 |
|---|---|
| Molecular Weight | 482.14 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 482.14243 |
| Heavy Atoms | 34 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 7801-91-4 |
|---|---|
| SMILES | C1=COC(C2C1C(C3C2(O3)CO)OC(=O)C4=CC=C(C=C4)O)OC5C(C(C(C(O5)CO)O)O)O |
| InChIKey | UXSACQOOWZMGSE-UHFFFAOYSA-N |
Product Overview
(Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate (CAS 7801-91-4), with molecular formula C22H26O12 and molecular weight 482.14 g/mol. IUPAC: [2-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxybenzoate.
Chemical Property Profile of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate
Property Insights of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate
The XLogP value of -1.3 indicates that (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate has 6 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 (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate?
The CAS number of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate is 7801-91-4.
What is the molecular formula of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate?
The molecular formula of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate is C22H26O12.
What is the molecular weight of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate?
The molecular weight of (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate is 482.14 g/mol.
Where can I buy (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate?
You can request a quote for (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (Hydroxybenzoyl)catalpol; Catalpol 6-p-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.