Praeruptorin E
TL;DR: Praeruptorin E (CAS 72463-77-5) is a chemical compound with molecular formula C24H28O7 and molecular weight 428.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(9S,10S)-8,8-dimethyl-10-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] (Z)-2-methylbut-2-enoate
Also Known As: Praeruptorin E, Praeruptorin C, (+)-Praeruptorin B, (+)-Praeruptorin E, Praeruptorin E (Standard)
| Molecular Formula | C24H28O7 |
|---|---|
| Molecular Weight | 428.18 g/mol |
| LogP | 4.4724 |
| Topological Polar Surface Area | 92.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.1835 |
| Heavy Atoms | 31 |
| Complexity | 1090.79 |
Chemical Identifiers
| CAS Number | 72463-77-5 |
|---|---|
| SMILES | C/C=C(/C)\C(=O)O[C@H]1[C@H](C2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C)OC(=O)CC(C)C |
Product Overview
Praeruptorin E (CAS 72463-77-5), with molecular formula C24H28O7 and molecular weight 428.18 g/mol. IUPAC: [(9S,10S)-8,8-dimethyl-10-(3-methylbutanoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-9-yl] (Z)-2-methylbut-2-enoate.
Chemical Property Profile of Praeruptorin E
Property Insights of Praeruptorin E
The XLogP value of 4.4724 indicates that Praeruptorin E is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.04 Ų falls within the moderate polarity range, balancing permeability and solubility for Praeruptorin E. Following Lipinski's Rule of Five, Praeruptorin E has 0 hydrogen bond donor(s) and 7 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 Praeruptorin E?
The CAS number of Praeruptorin E is 72463-77-5.
What is the molecular formula of Praeruptorin E?
The molecular formula of Praeruptorin E is C24H28O7.
What is the molecular weight of Praeruptorin E?
The molecular weight of Praeruptorin E is 428.18 g/mol.
Where can I buy Praeruptorin E?
You can request a quote for Praeruptorin E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Praeruptorin E?
Yes, KEHONG BIO provides custom synthesis services for Praeruptorin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.