Pleurotine
TL;DR: Pleurotine (CAS 1404-23-5) is a chemical compound with molecular formula C21H22O5 and molecular weight 354.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-7,16-dioxahexacyclo[13.6.1.01,8.04,21.09,14.018,22]docosa-9(14),11-diene-10,13,17-trione
Also Known As: Pleurotine, Pleurotine?, 6-methyl-2a,3,4,4a,5,6,7,8a,12b,12c-decahydro-2h-5,12d-ethanofuro[4',3',2':4,10]anthra[9,1-bc]oxepine-2,9,12-trione
| Molecular Formula | C21H22O5 |
|---|---|
| Molecular Weight | 354.15 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 354.14673 |
| Heavy Atoms | 26 |
| Complexity | 822.0 |
Chemical Identifiers
| CAS Number | 1404-23-5 |
|---|---|
| SMILES | CC1COC2C3=C(C4C5C26CCC1C6CCC5C(=O)O4)C(=O)C=CC3=O |
| InChIKey | QCPDBEXGCHOIDE-UHFFFAOYSA-N |
Product Overview
Pleurotine (CAS 1404-23-5), with molecular formula C21H22O5 and molecular weight 354.15 g/mol. IUPAC: 5-methyl-7,16-dioxahexacyclo[13.6.1.01,8.04,21.09,14.018,22]docosa-9(14),11-diene-10,13,17-trione.
Chemical Property Profile of Pleurotine
Property Insights of Pleurotine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pleurotine. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Pleurotine. Following Lipinski's Rule of Five, Pleurotine has 0 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 Pleurotine?
The CAS number of Pleurotine is 1404-23-5.
What is the molecular formula of Pleurotine?
The molecular formula of Pleurotine is C21H22O5.
What is the molecular weight of Pleurotine?
The molecular weight of Pleurotine is 354.15 g/mol.
Where can I buy Pleurotine?
You can request a quote for Pleurotine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pleurotine?
Yes, KEHONG BIO provides custom synthesis services for Pleurotine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.