Rabdophyllin H
TL;DR: Rabdophyllin H (CAS 102641-82-7) is a chemical compound with molecular formula C24H36O9 and molecular weight 468.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,5R,6S,7S,8R,9S,10S,11R)-10-acetyloxy-6,7,9,18-tetrahydroxy-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl]methyl acetate
Also Known As: Rabdophyllin H, 2-Pentenoic acid,4-bromo, [(1R,2S,5R,6S,7S,8R,9S,10S,11R)-10-acetyloxy-6,7,9,18-tetrahydroxy-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl]methyl acetate, 7,14,15,16-Tetrahydroxy-7,20-epoxykaurane-6,17-diyl diacetate, Kaurane-6,7,14,15,16,17-hexol, 7,20-epoxy-, 6,17-diacetate, (6beta,7alpha,14R,15beta)-
| Molecular Formula | C24H36O9 |
|---|---|
| Molecular Weight | 468.24 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 468.23593 |
| Heavy Atoms | 33 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 102641-82-7 |
|---|---|
| SMILES | CC(=O)OC[C@]1([C@@H]2CC[C@H]3[C@]45CCCC([C@H]4[C@@H]([C@]([C@@]3([C@@H]1O)C2O)(OC5)O)OC(=O)C)(C)C)O |
| InChIKey | QVVHQFHGOUAXTG-NERXGCNGSA-N |
Product Overview
Rabdophyllin H (CAS 102641-82-7), with molecular formula C24H36O9 and molecular weight 468.24 g/mol. IUPAC: [(1R,2S,5R,6S,7S,8R,9S,10S,11R)-10-acetyloxy-6,7,9,18-tetrahydroxy-12,12-dimethyl-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecan-6-yl]methyl acetate.
Chemical Property Profile of Rabdophyllin H
Property Insights of Rabdophyllin H
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rabdophyllin H. The TPSA of 143.0 Ų indicates high polarity, suggesting Rabdophyllin H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Rabdophyllin H has 4 hydrogen bond donor(s) and 9 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 Rabdophyllin H?
The CAS number of Rabdophyllin H is 102641-82-7.
What is the molecular formula of Rabdophyllin H?
The molecular formula of Rabdophyllin H is C24H36O9.
What is the molecular weight of Rabdophyllin H?
The molecular weight of Rabdophyllin H is 468.24 g/mol.
Where can I buy Rabdophyllin H?
You can request a quote for Rabdophyllin H directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rabdophyllin H?
Yes, KEHONG BIO provides custom synthesis services for Rabdophyllin H and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.