Cinatrin B
TL;DR: Cinatrin B (CAS 136266-34-7) is a chemical compound with molecular formula C18H28O8 and molecular weight 372.1784 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,5R)-8-decyl-3,4-dihydroxy-2,6-dioxo-1,7-dioxaspiro[4.4]nonane-4-carboxylic acid
Also Known As: Cinatrin B, (3R,5R)-8-DECYL-3,4-DIHYDROXY-2,6-DIOXO-1,7-DIOXASPIRO[4.4]NONANE-4-CARBOXYLIC ACID, (5R,7R)-2-decyl-6,7-dihydroxy-4,8-dioxo-3,9-dioxaspiro[4.4]nonane-6-carboxylic acid, 8-Decyl-3,4-dihydroxy-2,6-dioxo-1,7-dioxaspiro[4.4]nonane-4-carboxylic acid, 1,7-Dioxaspiro(4.4)nonane-4-carboxylic acid, 8-decyl-3,4-dihydroxy-2,6-dioxo-, (3R-(3alpha,4beta,5beta(R*)))-
Technical Specifications
| Molecular Formula | C18H28O8 |
| Molecular Weight | 372.1784 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 372.1784 Da |
| Heavy Atoms | 26 |
| Complexity | 547.0 |
| SMILES | CCCCCCCCCCC1C[C@]2(C(=O)O1)C([C@H](C(=O)O2)O)(C(=O)O)O |
| InChIKey | QUSVCUTZGWKBQJ-ZVRZEWSUSA-N |
Chemical Property Profile of Cinatrin B
Property Insights of Cinatrin B
The XLogP value of 3.6 indicates that Cinatrin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cinatrin B. Following Lipinski's Rule of Five, Cinatrin B has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Cinatrin B?
The CAS number of Cinatrin B is 136266-34-7.
What is the molecular formula of Cinatrin B?
The molecular formula of Cinatrin B is C18H28O8.
What is the molecular weight of Cinatrin B?
The molecular weight of Cinatrin B is 372.1784 g/mol.
Where can I buy Cinatrin B?
You can request a quote for Cinatrin B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cinatrin B?
Yes, CoreyChem provides custom synthesis services for Cinatrin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.