TL;DR: PGRR (CAS 102717-63-5) is a chemical compound with molecular formula C26H48O14 and molecular weight 584.3044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4S,5R,6R)-2-[(2S,3S,5R,6S)-6-[(2R,3R,4R,5S,6S)-5-hydroxy-4-methoxy-6-methyl-2-propoxyoxan-3-yl]oxy-4,5-dimethoxy-2-methyloxan-3-yl]oxy-4-methoxy-6-(methoxymethyl)oxane-3,5-diol
Also Known As: PGRR, (2S,3R,4S,5R,6R)-2-[(2S,3S,5R,6S)-6-[(2R,3R,4R,5S,6S)-5-hydroxy-4-methoxy-6-methyl-2-propoxyoxan-3-yl]oxy-4,5-dimethoxy-2-methyloxan-3-yl]oxy-4-methoxy-6-(methoxymethyl)oxane-3,5-diol, Propyl O-(3,6-di-O-methyl-beta-glucopyranosyl)-(1-4)-O-(2,3-di-O-methyl-alpha-rhamnopyranosyl)-(1-2)-3-O-methyl-alpha-rhamnopyranoside, Propyl 3,6-di-O-methyl-beta-D-glucopyranosyl-(1->4)-(3xi)-6-deoxy-2,3-di-O-methyl-alpha-L-arabino-hexopyranosyl-(1->2)-6-deoxy-3-O-methyl-alpha-L-mannopyranoside, Propyl 3,6-di-O-methylhexopyranosyl-(1->4)-6-deoxy-2,3-di-O-methylhexopyranosyl-(1->2)-6-deoxy-3-O-methylhexopyranoside
| Molecular Formula | C26H48O14 |
| Molecular Weight | 584.3044 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 162.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 13 |
| Exact Mass | 584.3044 Da |
| Heavy Atoms | 40 |
| Complexity | 732.0 |
| SMILES | CCCO[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)OC)O[C@H]2[C@@H](C([C@H]([C@@H](O2)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC)O)OC)O)OC)OC |
| InChIKey | ZASFTWIDVOCZOL-KQSKSNQTSA-N |
The XLogP value of -1.2 indicates that PGRR is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 162.0 Ų indicates high polarity, suggesting PGRR may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PGRR has 3 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of PGRR is 102717-63-5.
The molecular formula of PGRR is C26H48O14.
The molecular weight of PGRR is 584.3044 g/mol.
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