5-Deoxy-5-Fluoroarbekacin
[CAS# 119783-91-4]

Identification

• Name: 5-Deoxy-5-Fluoroarbekacin
• Synonyms: (2S)-4-Amino-N-[(1R,2S,3S,4R,5S)-5-Amino-4-[(2R,3R,6S)-3-Amino-6-(Aminomethyl)Tetrahydropyran-2-Yl]Oxy-2-[(2R,3R,4S,5S,6R)-4-Amino-3,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-3-Fluoro-Cyclohexyl]-2-Hydroxy-Butanamide; (2S)-4-Amino-N-[(1R,2S,3S,4R,5S)-5-Amino-4-[[(2R,3R,6S)-3-Amino-6-(Aminomethyl)-2-Tetrahydropyranyl]Oxy]-2-[[(2R,3R,4S,5S,6R)-4-Amino-3,5-Dihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-3-Fluorocyclohexyl]-2-Hydroxybutanamide; (2S)-4-Amino-N-[(1R,2S,3S,4R,5S)-5-Amino-4-[(2R,3R,6S)-3-Amino-6-(Aminomethyl)Tetrahydropyran-2-Yl]Oxy-2-[(2R,3R,4S,5S,6R)-4-Amino-3,5-Dihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-3-Fluoro-Cyclohexyl]-2-Hydroxy-Butyramide
• Molecular Formula: C₂₂H₄₃FN₆O₉
• Molecular Weight: 554.61
• CAS Registry Number: 119783-91-4
• SMILES: [C@@H]3(O[C@H]1O[C@@H]([C@@H](O)[C@H](N)[C@H]1O)CO)[C@@H](F)[C@H](O[C@H]2O[C@@H](CC[C@H]2N)CN)[C@@H](N)C[C@H]3NC(=O)[C@@H](O)CCN
• InChI: 1S/C22H43FN6O9/c23-14-18(37-21-9(26)2-1-8(6-25)35-21)10(27)5-11(29-20(34)12(31)3-4-24)19(14)38-22-17(33)15(28)16(32)13(7-30)36-22/h8-19,21-22,30-33H,1-7,24-28H2,(H,29,34)/t8-,9+,10-,11+,12-,13+,14-,15-,16+,17+,18+,19-,21+,22+/m0/s1
• InChIKey: ZJNVEFMFKDNZMU-VGBYYLGDSA-N

Properties

• Density: 1.451g/cm³ (Cal.)
• Boiling point: 870.444°C at 760 mmHg (Cal.)
• Flash point: 480.228°C (Cal.)