TL;DR: 2''-Amino-5,2''-dideoxyarbekacin (CAS 147920-23-8) is a chemical compound with molecular formula C22H45N7O8 and molecular weight 535.33295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-amino-N-[(1R,2R,4S,5S)-5-amino-4-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-[(2S,3R,4R,5S,6R)-3,4-diamino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]-2-hydroxybutanamide
Also Known As: 2''-Amino-5,2''-dideoxyarbekacin, 2 -Amino-2 ,5-dideoxyarbekacin, D-Streptamine, O-2,3-diamino-2,3-dideoxy-alpha-D-glucopyranosyl-(1-6)-O-(2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranosyl-(1-4))-N(sup 1)-(4-amino-2-hydroxy-1-oxobutyl)-2,5-dideoxy-, (S)-, (2S)-4-amino-N-[(1R,2R,4S,5S)-5-amino-4-[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy-2-[(2S,3R,4R,5S,6R)-3,4-diamino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]-2-hydroxybutanamide, (2S)-4-amino-N-[(1R,2R,4S,5S)-5-amino-4-{[(2R,3R,6S)-3-amino-6-(aminomethyl)oxan-2-yl]oxy}-2-{[(2S,3R,4R,5S,6R)-3,4-diamino-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohexyl]-2-hydroxybutanamide
| Molecular Formula | C22H45N7O8 |
| Molecular Weight | 535.33295 g/mol |
| XLogP | -6.0 |
| Topological Polar Surface Area (TPSA) | 283.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 535.33295 Da |
| Heavy Atoms | 37 |
| Complexity | 727.0 |
| SMILES | C1C[C@H]([C@H](O[C@@H]1CN)O[C@H]2C[C@H]([C@@H](C[C@@H]2N)NC(=O)[C@H](CCN)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)N)N)N |
| InChIKey | FSFLZIYCLPIOMU-JVEZQEQYSA-N |
The XLogP value of -6.0 indicates that 2''-Amino-5,2''-dideoxyarbekacin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 283.0 Ų indicates high polarity, suggesting 2''-Amino-5,2''-dideoxyarbekacin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2''-Amino-5,2''-dideoxyarbekacin has 10 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2''-Amino-5,2''-dideoxyarbekacin is 147920-23-8.
The molecular formula of 2''-Amino-5,2''-dideoxyarbekacin is C22H45N7O8.
The molecular weight of 2''-Amino-5,2''-dideoxyarbekacin is 535.33295 g/mol.
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