TL;DR: Kingianoside C (CAS 145854-04-2) is a chemical compound with molecular formula C45H72O20 and molecular weight 932.4617 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S,9S,13R,16S)-16-[(2R,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-6-[(3R)-3-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-en-10-one
Also Known As: Kingianoside C
| Molecular Formula | C45H72O20 |
| Molecular Weight | 932.4617 g/mol |
| XLogP | -2.3 |
| Topological Polar Surface Area (TPSA) | 324.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 13 |
| Exact Mass | 932.4617 Da |
| Heavy Atoms | 65 |
| Complexity | 1710.0 |
| SMILES | C[C@H]1C2C(CC3[C@@]2(C(=O)CC4C3CC=C5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)C)C)OC1(CC[C@@H](C)CO[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O |
| InChIKey | KQBLCRWJBXIFBJ-UZYOSAQZSA-N |
The XLogP value of -2.3 indicates that Kingianoside C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 324.0 Ų indicates high polarity, suggesting Kingianoside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Kingianoside C has 12 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Kingianoside C is 145854-04-2.
The molecular formula of Kingianoside C is C45H72O20.
The molecular weight of Kingianoside C is 932.4617 g/mol.
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