Subcordatolide C
TL;DR: Subcordatolide C (CAS 95732-44-8) is a chemical compound with molecular formula C19H26O5 and molecular weight 334.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3aR,4R,4aS,8R,8aR,9aR)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-4-yl] 2-methylpropanoate
Also Known As: Subcordatolide C, (3ar,4r,4as,8r,8ar,9ar)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxododecahydronaphtho[2,3-b]furan-4-yl 2-methylpropanoate, [(3aR,4R,4aS,8R,8aR,9aR)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-4-yl] 2-methylpropanoate, Propanoic acid, 2-methyl-, (3aR,4R,4aS,8R,8aR,9aR)-dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho(2,3-b)furan-4-yl ester, ((3aR,4R,4aS,8R,8aR,9aR)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo(f)(1)benzofuran-4-yl) 2-methylpropanoate
| Molecular Formula | C19H26O5 |
|---|---|
| Molecular Weight | 334.18 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.178 |
| Heavy Atoms | 24 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 95732-44-8 |
|---|---|
| SMILES | CC(C)C(=O)O[C@H]1[C@H]2[C@@H](C[C@@]3([C@@H]1C(=C)CC[C@H]3O)C)OC(=O)C2=C |
| InChIKey | GEAKLPVKLKYFLZ-LAOQMUKWSA-N |
Product Overview
Subcordatolide C (CAS 95732-44-8), with molecular formula C19H26O5 and molecular weight 334.18 g/mol. IUPAC: [(3aR,4R,4aS,8R,8aR,9aR)-8-hydroxy-8a-methyl-3,5-dimethylidene-2-oxo-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f][1]benzofuran-4-yl] 2-methylpropanoate.
Chemical Property Profile of Subcordatolide C
Property Insights of Subcordatolide C
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Subcordatolide C. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Subcordatolide C. Following Lipinski's Rule of Five, Subcordatolide C has 1 hydrogen bond donor(s) and 5 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 Subcordatolide C?
The CAS number of Subcordatolide C is 95732-44-8.
What is the molecular formula of Subcordatolide C?
The molecular formula of Subcordatolide C is C19H26O5.
What is the molecular weight of Subcordatolide C?
The molecular weight of Subcordatolide C is 334.18 g/mol.
Where can I buy Subcordatolide C?
You can request a quote for Subcordatolide C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Subcordatolide C?
Yes, KEHONG BIO provides custom synthesis services for Subcordatolide C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.