Pentisomicin
[CAS# 55870-64-9]

Identification

• Name: Pentisomicin
• Synonyms: (2R,3R,4R,5R)-2-[(1S,2R,3R,4S,6R)-4,6-Diamino-3-[[(2S,3R)-3-Amino-6-(Aminomethyl)-3,4-Dihydro-2H-Pyran-2-Yl]Oxy]-2-Hydroxy-Cyclohexoxy]-5-Methyl-4-Methylamino-Tetrahydropyran-3,5-Diol; (2R,3R,4R,5R)-2-[(1S,2R,3R,4S,6R)-4,6-Diamino-3-[[(2S,3R)-3-Amino-6-(Aminomethyl)-3,4-Dihydro-2H-Pyran-2-Yl]Oxy]-2-Hydroxycyclohexoxy]-5-Methyl-4-Methylaminotetrahydropyran-3,5-Diol; (2R,3R,4R,5R)-2-[(1S,2R,3R,4S,6R)-4,6-Diamino-3-[[(2S,3R)-3-Amino-6-(Aminomethyl)-3,4-Dihydro-2H-Pyran-2-Yl]Oxy]-2-Hydroxy-Cyclohexyl]Oxy-5-Methyl-4-Methylamino-Oxane-3,5-Diol
• Molecular Formula: C₁₉H₃₇N₅O₇
• Molecular Weight: 447.53
• CAS Registry Number: 55870-64-9
• SMILES: [C@H]2([C@@H]([C@H](O[C@H]1OC(=CC[C@H]1N)CN)[C@@H](N)C[C@H]2N)O)O[C@@H]3[C@@H]([C@H]([C@@](C)(O)CO3)NC)O
• InChI: 1S/C19H37N5O7/c1-19(27)7-28-18(13(26)16(19)24-2)31-15-11(23)5-10(22)14(12(15)25)30-17-9(21)4-3-8(6-20)29-17/h3,9-18,24-27H,4-7,20-23H2,1-2H3/t9-,10+,11-,12-,13-,14-,15+,16-,17-,18-,19+/m1/s1
• InChIKey: URWAJWIAIPFPJE-VHLNBGGKSA-N

Properties

• Density: 1.387g/cm³ (Cal.)
• Boiling point: 676.579°C at 760 mmHg (Cal.)
• Flash point: 362.982°C (Cal.)