TL;DR: Formosanin C (CAS 50773-42-7) is a chemical compound with molecular formula C51H82O20 and molecular weight 1014.5399 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S,4R,5R,6S)-2-[(2S,3R,4S,5R,6S)-4,5-dihydroxy-6-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[(1S,4S,5'R,6R,7S,8R,9S,12S,13R,16S)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-16-yl]oxy-5-[(2S,3R,4R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-2-methyloxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Also Known As: Formosanin C, Paris saponin II, CHONGLOU SAPONIN II, KST-1A5290, (3
| Molecular Formula | C51H82O20 |
| Molecular Weight | 1014.5399 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 295.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 9 |
| Exact Mass | 1014.5399 Da |
| Heavy Atoms | 71 |
| Complexity | 1900.0 |
| SMILES | C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)CC4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O[C@H]9[C@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)O)O)O)O[C@H]2[C@@H]([C@@H](C([C@@H](O2)C)O)O)O)C)C)C)OC1 |
| InChIKey | OZIHYFWYFUSXIS-KORJSKJVSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Formosanin C. The TPSA of 295.0 Ų indicates high polarity, suggesting Formosanin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Formosanin C has 10 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Formosanin C is 50773-42-7.
The molecular formula of Formosanin C is C51H82O20.
The molecular weight of Formosanin C is 1014.5399 g/mol.
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