TL;DR: Diuranthoside C (CAS 132998-88-0) is a chemical compound with molecular formula C62H100O33 and molecular weight 1372.6147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5'S,6R,7S,9S,13S,16S,18S)-16-[(2R,3R,4R,5R,6R)-5-[(2S,3R,4S,5R,6R)-3-[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one
Also Known As: Diuranthoside C
| Molecular Formula | C62H100O33 |
| Molecular Weight | 1372.6147 g/mol |
| XLogP | -5.2 |
| Topological Polar Surface Area (TPSA) | 510.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 33 |
| Rotatable Bonds | 17 |
| Exact Mass | 1372.6147 Da |
| Heavy Atoms | 95 |
| Complexity | 2570.0 |
| SMILES | C[C@H]1CC[C@@]2([C@H](C3C(O2)CC4[C@@]3(C(=O)CC5C4CC[C@@H]6[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)CO)O)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)C)C)C)OC1 |
| InChIKey | LIMAWRXWMAIOLU-DPHQMKTNSA-N |
The XLogP value of -5.2 indicates that Diuranthoside C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 510.0 Ų indicates high polarity, suggesting Diuranthoside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Diuranthoside C has 18 hydrogen bond donor(s) and 33 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Diuranthoside C is 132998-88-0.
The molecular formula of Diuranthoside C is C62H100O33.
The molecular weight of Diuranthoside C is 1372.6147 g/mol.
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