Antiquorin
TL;DR: Antiquorin (CAS 125356-08-3) is a chemical compound with molecular formula C20H28O3 and molecular weight 316.20386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,9S,12R)-13-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-6,14-dione
Also Known As: Antiquorin, NCI60_013494, (13R)-13-Hydroxy-ent-atis-16-ene-3,14-dione, (1R,9S,12R)-13-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo[10.2.2.01,10.04,9]hexadecane-6,14-dione, (1R,9S,12R)-13-hydroxy-5,5,9-trimethyl-16-methylidenetetracyclo(10.2.2.01,10.04,9)hexadecane-6,14-dione
Technical Specifications
| Molecular Formula | C20H28O3 |
| Molecular Weight | 316.20386 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 316.20386 Da |
| Heavy Atoms | 23 |
| Complexity | 618.0 |
| SMILES | C[C@]12CCC(=O)C(C1CC[C@@]34C2C[C@@H](C(C3=O)O)C(=C)C4)(C)C |
| InChIKey | UQKJSKXVMBIKGF-ZSWWFFRDSA-N |
Chemical Property Profile of Antiquorin
Property Insights of Antiquorin
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Antiquorin. With a topological polar surface area (TPSA) of 54.4 Ų, Antiquorin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Antiquorin has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Antiquorin?
The CAS number of Antiquorin is 125356-08-3.
What is the molecular formula of Antiquorin?
The molecular formula of Antiquorin is C20H28O3.
What is the molecular weight of Antiquorin?
The molecular weight of Antiquorin is 316.20386 g/mol.
Where can I buy Antiquorin?
You can request a quote for Antiquorin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Antiquorin?
Yes, CoreyChem provides custom synthesis services for Antiquorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.