TL;DR: (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid (CAS 101759-17-5) is a chemical compound with molecular formula C7H11NO3 and molecular weight 157.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid
Also Known As: (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid, 2-amino-4-hydroxyhept-6-ynoic acid, (R-(R*,S*))-2-Amino-4-hydroxy-6-heptynoic acid, 6-Heptynoic acid, 2-amino-4-hydroxy-, (R-(R*,S*))-
| Molecular Formula | C7H11NO3 |
| Molecular Weight | 157.0739 g/mol |
| XLogP | -3.0 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 157.0739 Da |
| Heavy Atoms | 11 |
| Complexity | 181.0 |
| SMILES | C#CC[C@H](C[C@@H](C(=O)O)N)O |
| InChIKey | ZESDLVJGIBGADW-RITPCOANSA-N |
The XLogP value of -3.0 indicates that (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid. Following Lipinski's Rule of Five, (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid is 101759-17-5.
The molecular formula of (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid is C7H11NO3.
The molecular weight of (2S,4R)-2-amino-4-hydroxyhept-6-ynoic acid is 157.0739 g/mol.
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