1-[2-Methyl-1-[[2-[2-[2-(Oxidoamino)-2-Oxoethyl]Hexanoyl]Diazinane-3-Carbonyl]Amino]Butyl]-5,6,7,8-Tetrahydropyrazolo[1,2-a]Pyridazin-4-Ium-8-Carboxylic Acid
[CAS 140638-26-2]

Identification

• Name: 1-[2-Methyl-1-[[2-[2-[2-(Oxidoamino)-2-Oxoethyl]Hexanoyl]Diazinane-3-Carbonyl]Amino]Butyl]-5,6,7,8-Tetrahydropyrazolo[1,2-a]Pyridazin-4-Ium-8-Carboxylic Acid
• Synonyms: 1-[2-Methyl-1-[[2-[2-[2-(Oxidoamino)-2-Oxo-Ethyl]Hexanoyl]Hexahydropyridazine-3-Carbonyl]Amino]Butyl]-5,6,7,8-Tetrahydropyrazolo[1,2-A]Pyridazin-4-Ium-8-Carboxylic Acid; 1-[2-Methyl-1-[[[2-[2-[2-(Oxidoamino)-2-Oxoethyl]-1-Oxohexyl]-3-Hexahydropyridazinyl]-Oxomethyl]Amino]Butyl]-5,6,7,8-Tetrahydropyrazolo[1,2-A]Pyridazin-4-Ium-8-Carboxylic Acid; 1-[1-[[2-[2-[2-Keto-2-(Oxidoamino)Ethyl]Hexanoyl]Hexahydropyridazine-3-Carbonyl]Amino]-2-Methyl-Butyl]-5,6,7,8-Tetrahydropyrazolo[1,2-A]Pyridazin-4-Ium-8-Carboxylic Acid
• Molecular Formula: C₂₆H₄₂N₆O₆
• Molecular Weight: 534.65
• CAS Registry Number: 140638-26-2
• SMILES: C1=C([N]2[N+](=C1)CCCC2C(=O)O)C(NC(=O)C3N(NCCC3)C(=O)C(CC(=O)N[O-])CCCC)C(CC)C
• InChI: 1S/C26H42N6O6/c1-4-6-9-18(16-22(33)29-38)25(35)31-20(10-7-13-27-31)24(34)28-23(17(3)5-2)19-12-15-30-14-8-11-21(26(36)37)32(19)30/h12,15,17-18,20-21,23,27H,4-11,13-14,16H2,1-3H3,(H3-,28,29,33,34,36,37,38)
• InChIKey: FALJVYVMSWFILZ-UHFFFAOYSA-N