Pseurotin D
TL;DR: Pseurotin D (CAS 77409-68-8) is a chemical compound with molecular formula C18H28O4 and molecular weight 308.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,8S,13S,14R)-5-hydroxy-8-methoxy-5,9,13,14-tetramethyl-1-oxacyclotetradeca-3,6,9-trien-2-one
Also Known As: Pseurotin D, (5R,8S,13S,14R)-5-Hydroxy-8-methoxy-5,9,13,14-tetramethyl-1-oxacyclotetradeca-3,6,9-trien-2-one
| Molecular Formula | C18H28O4 |
|---|---|
| Molecular Weight | 308.20 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 308.19876 |
| Heavy Atoms | 22 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 77409-68-8 |
|---|---|
| SMILES | C[C@H]1CCC=C([C@H](C=C[C@@](C=CC(=O)O[C@@H]1C)(C)O)OC)C |
| InChIKey | BYWWNDLILWPPJP-JXSMBQFASA-N |
Product Overview
Pseurotin D (CAS 77409-68-8), with molecular formula C18H28O4 and molecular weight 308.20 g/mol. IUPAC: (5R,8S,13S,14R)-5-hydroxy-8-methoxy-5,9,13,14-tetramethyl-1-oxacyclotetradeca-3,6,9-trien-2-one.
Chemical Property Profile of Pseurotin D
Property Insights of Pseurotin D
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseurotin D. With a topological polar surface area (TPSA) of 55.8 Ų, Pseurotin D exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pseurotin D has 1 hydrogen bond donor(s) and 4 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 Pseurotin D?
The CAS number of Pseurotin D is 77409-68-8.
What is the molecular formula of Pseurotin D?
The molecular formula of Pseurotin D is C18H28O4.
What is the molecular weight of Pseurotin D?
The molecular weight of Pseurotin D is 308.20 g/mol.
Where can I buy Pseurotin D?
You can request a quote for Pseurotin D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseurotin D?
Yes, KEHONG BIO provides custom synthesis services for Pseurotin D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.