From marine sponge Spongionella gracilis
TL;DR: From marine sponge Spongionella gracilis (CAS 96313-95-0) is a chemical compound with molecular formula C22H28O8 and molecular weight 420.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-acetyloxy-11-[2-(3,3-dimethylcyclohexylidene)ethylidene]-10-oxo-5,7,9-trioxatricyclo[6.3.0.02,6]undecan-3-yl] acetate
Also Known As: From marine sponge Spongionella gracilis
| Molecular Formula | C22H28O8 |
|---|---|
| Molecular Weight | 420.18 g/mol |
| LogP | 2.7621 |
| Topological Polar Surface Area | 97.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.1784 |
| Heavy Atoms | 30 |
| Complexity | 809.9552 |
Chemical Identifiers
| CAS Number | 96313-95-0 |
|---|---|
| SMILES | CC(=O)OC1C2C3C(OC2OC1OC(=O)C)OC(=O)C3=CC=C4CCCC(C4)(C)C |
Product Overview
From marine sponge Spongionella gracilis (CAS 96313-95-0), with molecular formula C22H28O8 and molecular weight 420.18 g/mol. IUPAC: [4-acetyloxy-11-[2-(3,3-dimethylcyclohexylidene)ethylidene]-10-oxo-5,7,9-trioxatricyclo[6.3.0.02,6]undecan-3-yl] acetate.
Chemical Property Profile of From marine sponge Spongionella gracilis
Property Insights of From marine sponge Spongionella gracilis
The XLogP value of 2.7621 suggests moderate lipophilicity, balancing water solubility and membrane permeability for From marine sponge Spongionella gracilis. The TPSA of 97.36 Ų falls within the moderate polarity range, balancing permeability and solubility for From marine sponge Spongionella gracilis. Following Lipinski's Rule of Five, From marine sponge Spongionella gracilis has 0 hydrogen bond donor(s) and 8 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 From marine sponge Spongionella gracilis?
The CAS number of From marine sponge Spongionella gracilis is 96313-95-0.
What is the molecular formula of From marine sponge Spongionella gracilis?
The molecular formula of From marine sponge Spongionella gracilis is C22H28O8.
What is the molecular weight of From marine sponge Spongionella gracilis?
The molecular weight of From marine sponge Spongionella gracilis is 420.18 g/mol.
Where can I buy From marine sponge Spongionella gracilis?
You can request a quote for From marine sponge Spongionella gracilis directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for From marine sponge Spongionella gracilis?
Yes, KEHONG BIO provides custom synthesis services for From marine sponge Spongionella gracilis and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.