2-Amino-5-[[[(Aminocarbonyl)Amino]Acetyl]Methylamino]-1-O-(2,6-Diamino-2,3,4,6,7-Pentadeoxy-beta-L-Lyxo-Heptopyranosyl)-4-O-Methyl-2,3,5-Trideoxy-D-Allo-Inositol
[CAS# 68743-80-6]

Identification

• Name: 2-Amino-5-[[[(Aminocarbonyl)Amino]Acetyl]Methylamino]-1-O-(2,6-Diamino-2,3,4,6,7-Pentadeoxy-beta-L-Lyxo-Heptopyranosyl)-4-O-Methyl-2,3,5-Trideoxy-D-Allo-Inositol
• Synonyms: N-[4-Amino-3-[3-Amino-6-(1-Aminoethyl)Tetrahydropyran-2-Yl]Oxy-2-Hydroxy-6-Methoxy-Cyclohexyl]-N-Methyl-2-Ureido-Acetamide; N-[4-Amino-3-[[3-Amino-6-(1-Aminoethyl)-2-Tetrahydropyranyl]Oxy]-2-Hydroxy-6-Methoxycyclohexyl]-N-Methyl-2-Ureidoacetamide; N-[4-Amino-3-[3-Amino-6-(1-Aminoethyl)Oxan-2-Yl]Oxy-2-Hydroxy-6-Methoxy-Cyclohexyl]-2-(Aminocarbonylamino)-N-Methyl-Ethanamide
• Molecular Formula: C₁₈H₃₆N₆O₆
• Molecular Weight: 432.52
• CAS Registry Number: 68743-80-6
• SMILES: C(C(N(C1C(CC(C(C1O)OC2C(CCC(O2)C(C)N)N)N)OC)C)=O)NC(N)=O
• InChI: 1S/C18H36N6O6/c1-8(19)11-5-4-9(20)17(29-11)30-16-10(21)6-12(28-3)14(15(16)26)24(2)13(25)7-23-18(22)27/h8-12,14-17,26H,4-7,19-21H2,1-3H3,(H3,22,23,27)
• InChIKey: PUURLTDHGIJACO-UHFFFAOYSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 640.034°C at 760 mmHg (Cal.)
• Flash point: 340.88°C (Cal.)