TL;DR: Nojirimycin 6-phosphate (CAS 116026-80-3) is a chemical compound with molecular formula C6H14NO8P and molecular weight 259.04572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4,5,6-tetrahydroxypiperidin-2-yl)methyl dihydrogen phosphate
Also Known As: Nojirimycin 6-phosphate, KST-1A1146, (3,4,5,6-tetrahydroxypiperidin-2-yl)methyl dihydrogen phosphate, 2-Pyridinecarboxaldehyde,o-ethyloxime,(Z)-(9ci), 2,3,4,5-Piperidinetetrol,6-[(phosphonooxy)methyl]- (9CI)
| Molecular Formula | C6H14NO8P |
| Molecular Weight | 259.04572 g/mol |
| XLogP | -6.8 |
| Topological Polar Surface Area (TPSA) | 160.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.04572 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | C(C1C(C(C(C(N1)O)O)O)O)OP(=O)(O)O |
| InChIKey | GOGMMRLMDFIUBC-UHFFFAOYSA-N |
The XLogP value of -6.8 indicates that Nojirimycin 6-phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting Nojirimycin 6-phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nojirimycin 6-phosphate has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Nojirimycin 6-phosphate is 116026-80-3.
The molecular formula of Nojirimycin 6-phosphate is C6H14NO8P.
The molecular weight of Nojirimycin 6-phosphate is 259.04572 g/mol.
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