chlormadinol acetate-3-O-alpha-arabinofuranoside
TL;DR: chlormadinol acetate-3-O-alpha-arabinofuranoside (CAS 129990-43-8) is a chemical compound with molecular formula C28H40O8 and molecular weight 504.2723 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3S,8R,9S,10R,13S,14S,17R)-17-acetyl-3-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate
Also Known As: CAAF, Chlormadinol acetate-3-O-alpha-arabinofuranoside, (3beta)-17-(Acetyloxy)-3-(alpha-L-arabinofuranosyloxy)pregna-4,6-dien-20-one, 17-Acetoxy-6-chloropregna-4,6-diene-20-one-3-O-alpha-arabinofuranoside, [(3S,8R,9S,10R,13S,14S,17R)-17-acetyl-3-[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-10,13-dimethyl-1,2,3,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate
Technical Specifications
| Molecular Formula | C28H40O8 |
| Molecular Weight | 504.2723 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 504.2723 Da |
| Heavy Atoms | 36 |
| Complexity | 975.0 |
| SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=CC4=C[C@H](CC[C@]34C)O[C@H]5[C@@H]([C@H]([C@@H](O5)CO)O)O)C)OC(=O)C |
| InChIKey | DBJOUOZKGVPNLE-HQNOGBBKSA-N |
Chemical Property Profile of chlormadinol acetate-3-O-alpha-arabinofuranoside
Property Insights of chlormadinol acetate-3-O-alpha-arabinofuranoside
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for chlormadinol acetate-3-O-alpha-arabinofuranoside. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for chlormadinol acetate-3-O-alpha-arabinofuranoside. Following Lipinski's Rule of Five, chlormadinol acetate-3-O-alpha-arabinofuranoside has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of chlormadinol acetate-3-O-alpha-arabinofuranoside?
The CAS number of chlormadinol acetate-3-O-alpha-arabinofuranoside is 129990-43-8.
What is the molecular formula of chlormadinol acetate-3-O-alpha-arabinofuranoside?
The molecular formula of chlormadinol acetate-3-O-alpha-arabinofuranoside is C28H40O8.
What is the molecular weight of chlormadinol acetate-3-O-alpha-arabinofuranoside?
The molecular weight of chlormadinol acetate-3-O-alpha-arabinofuranoside is 504.2723 g/mol.
Where can I buy chlormadinol acetate-3-O-alpha-arabinofuranoside?
You can request a quote for chlormadinol acetate-3-O-alpha-arabinofuranoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for chlormadinol acetate-3-O-alpha-arabinofuranoside?
Yes, CoreyChem provides custom synthesis services for chlormadinol acetate-3-O-alpha-arabinofuranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.