TL;DR: 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin (CAS 155168-05-1) is a chemical compound with molecular formula C12H23NO9 and molecular weight 325.13727 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4S,5R,6R)-2-[(3S,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)piperidin-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Galactosyl-DNJ, 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin, 2-O-alpha-D-Galactopyranosyl-1-deoxynojirimycin, 2-O-?-D-Galactopyranosyl-1-deoxynojirimycin, 2-O-alpha-D-galactopyranosyl deoxynojirimycin
| Molecular Formula | C12H23NO9 |
| Molecular Weight | 325.13727 g/mol |
| XLogP | -3.9 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.13727 Da |
| Heavy Atoms | 22 |
| Complexity | 359.0 |
| SMILES | C1[C@@H]([C@H]([C@@H]([C@H](N1)CO)O)O)O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O |
| InChIKey | CQLSQWAVFSEMIE-QZNPSGCDSA-N |
The XLogP value of -3.9 indicates that 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.0 Ų indicates high polarity, suggesting 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin is 155168-05-1.
The molecular formula of 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin is C12H23NO9.
The molecular weight of 2-O-a-D-Galactopyranosyl-1-deoxynojirimycin is 325.13727 g/mol.
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