TL;DR: (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate (CAS 1061740-00-8) is a chemical compound with molecular formula C8H15NO6 and molecular weight 221.08994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R,5R,6R)-6-[(1R)-2-amino-1-hydroxyethyl]-4,5-dihydroxyoxane-2-carboxylic acid
Also Known As: AADHC, NH2dKDO, 8-Amino-2,6-anhydro-3,8-dideoxy-D-glycero-D-talo-octonic acid, (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate, J2.044.048A
| Molecular Formula | C8H15NO6 |
| Molecular Weight | 221.08994 g/mol |
| XLogP | -4.6 |
| Topological Polar Surface Area (TPSA) | 133.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.08994 Da |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
| SMILES | C1[C@H]([C@H]([C@H](O[C@@H]1C(=O)O)[C@@H](CN)O)O)O |
| InChIKey | JOMLPRUJCYAJKS-XUUWZHRGSA-N |
The XLogP value of -4.6 indicates that (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate. Following Lipinski's Rule of Five, (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate is 1061740-00-8.
The molecular formula of (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate is C8H15NO6.
The molecular weight of (1,5-Anhydro-7-amino-2,7-dideoxyheptopyranosyl)carboxylate is 221.08994 g/mol.
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