TL;DR: XFAXX (CAS 114216-65-8) is a chemical compound with molecular formula C30H42O20 and molecular weight 722.2269 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2S,3R,4R,5R)-3-hydroxy-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R)-1,3,4-trihydroxy-5-oxopentan-2-yl]oxyoxan-4-yl]oxyoxolan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Also Known As: XFAXX, [(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2S,3R,4R,5R)-3-hydroxy-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2-[(2R,3R,4R)-1,3,4-trihydroxy-5-oxopentan-2-yl]oxyoxan-4-yl]oxyoxolan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate, O-beta-Xylopyranosyl-(1-4)-O-(5-O-feruloyl-alpha-arabinofuranosyl-(1-3))-O-beta-xylopyranosyl-(1-4)-xylopyranose, O-beta-xylopyranosyl-(1-4)-O-(5-O-feruloyl-alpha-arabinofuranosyl-(1-3))-O-beta-xylopyranosyl-(1-4)-
| Molecular Formula | C30H42O20 |
| Molecular Weight | 722.2269 g/mol |
| XLogP | -5.1 |
| Topological Polar Surface Area (TPSA) | 310.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 16 |
| Exact Mass | 722.2269 Da |
| Heavy Atoms | 50 |
| Complexity | 1100.0 |
| SMILES | COC1=C(C=CC(=C1)/C=C/C(=O)OC[C@H]2[C@@H]([C@H]([C@@H](O2)O[C@H]3[C@@H](CO[C@H]([C@@H]3O)O[C@H](CO)[C@@H]([C@H](C=O)O)O)O[C@H]4[C@@H]([C@H]([C@@H](CO4)O)O)O)O)O)O |
| InChIKey | UMSSASUOLWJSAP-VNINZPMBSA-N |
The XLogP value of -5.1 indicates that XFAXX is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 310.0 Ų indicates high polarity, suggesting XFAXX may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, XFAXX has 10 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of XFAXX is 114216-65-8.
The molecular formula of XFAXX is C30H42O20.
The molecular weight of XFAXX is 722.2269 g/mol.
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