Compactin diol lactone
TL;DR: Compactin diol lactone (CAS 58889-19-3) is a chemical compound with molecular formula C18H26O4 and molecular weight 306.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,6R)-6-[2-[(1S,2S,8S,8aR)-8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one
Also Known As: Compactin diol lactone, DesmethylmonacolinJ, desmethylmonacolin J, ML 236A, Antibiotic ML 236A
| Molecular Formula | C18H26O4 |
|---|---|
| Molecular Weight | 306.18 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.1831 |
| Heavy Atoms | 22 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 58889-19-3 |
|---|---|
| SMILES | C[C@H]1C=CC2=CCC[C@@H]([C@@H]2[C@H]1CC[C@@H]3C[C@H](CC(=O)O3)O)O |
| InChIKey | WWSNTLOVYSRDEL-DZSDEGEFSA-N |
Product Overview
Compactin diol lactone (CAS 58889-19-3), with molecular formula C18H26O4 and molecular weight 306.18 g/mol. IUPAC: (4R,6R)-6-[2-[(1S,2S,8S,8aR)-8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxyoxan-2-one.
Chemical Property Profile of Compactin diol lactone
Property Insights of Compactin diol lactone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Compactin diol lactone. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Compactin diol lactone. Following Lipinski's Rule of Five, Compactin diol lactone has 2 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 Compactin diol lactone?
The CAS number of Compactin diol lactone is 58889-19-3.
What is the molecular formula of Compactin diol lactone?
The molecular formula of Compactin diol lactone is C18H26O4.
What is the molecular weight of Compactin diol lactone?
The molecular weight of Compactin diol lactone is 306.18 g/mol.
Where can I buy Compactin diol lactone?
You can request a quote for Compactin diol lactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Compactin diol lactone?
Yes, KEHONG BIO provides custom synthesis services for Compactin diol lactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.