Praeruptorin B
TL;DR: Praeruptorin B (CAS 73069-26-8) is a chemical compound with molecular formula C24H26O7 and molecular weight 426.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[8,8-dimethyl-9-(2-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 2-methylbut-2-enoate
Also Known As: Praeruptorin B, Praeruptorin D, Anomalin, (-)-Anomalin, (-)-Praeruptorin B
| Molecular Formula | C24H26O7 |
|---|---|
| Molecular Weight | 426.17 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.16785 |
| Heavy Atoms | 31 |
| Complexity | 835.0 |
Chemical Identifiers
| CAS Number | 73069-26-8 |
|---|---|
| SMILES | CC=C(C)C(=O)OC1C(C(OC2=C1C3=C(C=C2)C=CC(=O)O3)(C)C)OC(=O)C(=CC)C |
| InChIKey | PNTWXEIQXBRCPS-UHFFFAOYSA-N |
Product Overview
Praeruptorin B (CAS 73069-26-8), with molecular formula C24H26O7 and molecular weight 426.17 g/mol. IUPAC: [8,8-dimethyl-9-(2-methylbut-2-enoyloxy)-2-oxo-9,10-dihydropyrano[2,3-f]chromen-10-yl] 2-methylbut-2-enoate.
Chemical Property Profile of Praeruptorin B
Property Insights of Praeruptorin B
The XLogP value of 4.3 indicates that Praeruptorin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Praeruptorin B. Following Lipinski's Rule of Five, Praeruptorin B 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 B?
The CAS number of Praeruptorin B is 73069-26-8.
What is the molecular formula of Praeruptorin B?
The molecular formula of Praeruptorin B is C24H26O7.
What is the molecular weight of Praeruptorin B?
The molecular weight of Praeruptorin B is 426.17 g/mol.
Where can I buy Praeruptorin B?
You can request a quote for Praeruptorin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Praeruptorin B?
Yes, KEHONG BIO provides custom synthesis services for Praeruptorin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.