[(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13
TL;DR: [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 (CAS 73465-46-0) is a chemical compound with molecular formula C25H36O4 and molecular weight 400.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,8R,9S,10R,13S,14S)-17-(1-acetyloxyethylidene)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate
Also Known As: [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13
| Molecular Formula | C25H36O4 |
|---|---|
| Molecular Weight | 400.26 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.26135 |
| Heavy Atoms | 29 |
| Complexity | 778.0 |
Chemical Identifiers
| CAS Number | 73465-46-0 |
|---|---|
| SMILES | CC(=C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C)OC(=O)C |
| InChIKey | DQHKOPGHSPUDFM-ABVATSDPSA-N |
Product Overview
[(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 (CAS 73465-46-0), with molecular formula C25H36O4 and molecular weight 400.26 g/mol. IUPAC: [(3S,8R,9S,10R,13S,14S)-17-(1-acetyloxyethylidene)-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13
Property Insights of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13
The XLogP value of 5.0 indicates that [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 has 0 hydrogen bond donor(s) and 4 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 [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13?
The CAS number of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 is 73465-46-0.
What is the molecular formula of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13?
The molecular formula of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 is C25H36O4.
What is the molecular weight of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13?
The molecular weight of [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 is 400.26 g/mol.
Where can I buy [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13?
You can request a quote for [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13?
Yes, KEHONG BIO provides custom synthesis services for [(3S,8R,9S,10R,13S,14S,17E)-17-(1-acetyloxyethylidene)-10,13 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.