Oxysceptrin
[CAS# 117417-62-6]

Identification

• Name: Oxysceptrin
• Synonyms: N-[[3-(2-Amino-3H-Imidazol-4-Yl)-2-(2-Amino-5-Oxo-1,4-Dihydroimidazol-4-Yl)-4-[[[(4-Bromo-1H-Pyrrol-2-Yl)-Oxomethyl]Amino]Methyl]Cyclobutyl]Methyl]-4-Bromo-1H-Pyrrole-2-Carboxamide; N-[[3-(2-Amino-3H-Imidazol-4-Yl)-2-(2-Amino-5-Keto-1,4-Dihydroimidazol-4-Yl)-4-[[(4-Bromo1h-Pyrrole-2-Carbonyl)Amino]Methyl]Cyclobutyl]Methyl]-4-Bromo-1H-Pyrrole-2-Carboxamide; N-[[3-(2-Amino-3H-Imidazol-4-Yl)-2-(2-Amino-5-Oxo-1,4-Dihydroimidazol-4-Yl)-4-[[(4-Bromo-1H-Pyrrol-2-Yl)Carbonylamino]Methyl]Cyclobutyl]Methyl]-4-Bromo-1H-Pyrrole-2-Carboxamide
• Molecular Formula: C₂₂H₂₄Br₂N₁₀O₃
• Molecular Weight: 636.30
• CAS Registry Number: 117417-62-6
• SMILES: C1=C([NH]C(=N1)N)C2C(C(C2CNC(=O)C3=CC(=C[NH]3)Br)CNC(=O)C4=CC(=C[NH]4)Br)C5N=C(NC5=O)N
• InChI: 1S/C22H24Br2N10O3/c23-8-1-12(27-3-8)18(35)29-5-10-11(6-30-19(36)13-2-9(24)4-28-13)16(17-20(37)34-22(26)33-17)15(10)14-7-31-21(25)32-14/h1-4,7,10-11,15-17,27-28H,5-6H2,(H,29,35)(H,30,36)(H3,25,31,32)(H3,26,33,34,37)
• InChIKey: BCDVBQKLSBGFBQ-UHFFFAOYSA-N

Properties

• Density: 2.18g/cm³ (Cal.)