8,9-Didehydro-10-ketoryanodine
TL;DR: 8,9-Didehydro-10-ketoryanodine (CAS 106821-52-7) is a chemical compound with molecular formula C25H31NO9 and molecular weight 489.1999 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6,9,11,13,14-pentahydroxy-3,7,10-trimethyl-2-oxo-11-propan-2-yl-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadec-3-en-12-yl) 1H-pyrrole-2-carboxylate
Also Known As: 8,9-Didehydro-10-ketoryanodine, 8,9-Didehydro-10-deoxy-10-oxoryanodol 3-(1H-pyrrole-2-carboxylate), Ryanodol, 8,9-didehydro-10-deoxy-10-oxo-, 3-(1H-pyrrole-2-carboxylate), 6,7,8a,8b,9a-Pentahydroxy-3,6a,9-trimethyl-4-oxo-7-(propan-2-yl)-1,4,6,6a,7,8,8a,8b,9,9a-decahydro-6,9-methanobenzo[1,2]pentaleno[1,6-bc]furan-8-yl 1H-pyrrole-2-carboxylate
Technical Specifications
| Molecular Formula | C25H31NO9 |
| Molecular Weight | 489.1999 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 170.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 489.1999 Da |
| Heavy Atoms | 35 |
| Complexity | 1110.0 |
| SMILES | CC1=CCC2(C3(CC4(C5(C(C(C3(C5(C2(C1=O)O4)O)O)OC(=O)C6=CC=CN6)(C(C)C)O)C)O)C)O |
| InChIKey | FJBQJGVCHRSEIM-UHFFFAOYSA-N |
Chemical Property Profile of 8,9-Didehydro-10-ketoryanodine
Property Insights of 8,9-Didehydro-10-ketoryanodine
The XLogP value of -0.4 indicates that 8,9-Didehydro-10-ketoryanodine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 170.0 Ų indicates high polarity, suggesting 8,9-Didehydro-10-ketoryanodine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8,9-Didehydro-10-ketoryanodine has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 8,9-Didehydro-10-ketoryanodine?
The CAS number of 8,9-Didehydro-10-ketoryanodine is 106821-52-7.
What is the molecular formula of 8,9-Didehydro-10-ketoryanodine?
The molecular formula of 8,9-Didehydro-10-ketoryanodine is C25H31NO9.
What is the molecular weight of 8,9-Didehydro-10-ketoryanodine?
The molecular weight of 8,9-Didehydro-10-ketoryanodine is 489.1999 g/mol.
Where can I buy 8,9-Didehydro-10-ketoryanodine?
You can request a quote for 8,9-Didehydro-10-ketoryanodine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 8,9-Didehydro-10-ketoryanodine?
Yes, CoreyChem provides custom synthesis services for 8,9-Didehydro-10-ketoryanodine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.