N-beta-Acetylstreptothricin E
[CAS# 52599-88-9]

Identification

• Name: N-beta-Acetylstreptothricin E
• Synonyms: [5-[[6-[(6-Acetamido-3-Amino-Hexanoyl)Amino]-3-Amino-Hexanoyl]Amino]-4-Hydroxy-2-(Hydroxymethyl)-6-[(7-Hydroxy-4-Oxo-1,3A,5,6,7,7A-Hexahydroimidazo[4,5-C]Pyridin-2-Yl)Amino]Tetrahydropyran-3-Yl] Carbamate; Carbamic Acid [5-[[6-[(6-Acetamido-3-Amino-1-Oxohexyl)Amino]-3-Amino-1-Oxohexyl]Amino]-4-Hydroxy-2-(Hydroxymethyl)-6-[(7-Hydroxy-4-Oxo-1,3A,5,6,7,7A-Hexahydroimidazo[4,5-C]Pyridin-2-Yl)Amino]-3-Tetrahydropyranyl] Ester; Carbamic Acid [5-[[6-[(6-Acetamido-3-Amino-Hexanoyl)Amino]-3-Amino-Hexanoyl]Amino]-4-Hydroxy-6-[(7-Hydroxy-4-Keto-1,3A,5,6,7,7A-Hexahydroimidazo[4,5-C]Pyridin-2-Yl)Amino]-2-Methylol-Tetrahydropyran-3-Yl] Ester
• Molecular Formula: C₂₇H₄₈N₁₀O₁₀
• Molecular Weight: 672.74
• CAS Registry Number: 52599-88-9
• SMILES: C(C(NC1C(OC(C(C1O)OC(=O)N)CO)NC2=NC3C(N2)C(CNC3=O)O)=O)C(N)CCCNC(CC(CCCNC(C)=O)N)=O
• InChI: 1S/C27H48N10O10/c1-12(39)31-6-2-4-13(28)8-17(41)32-7-3-5-14(29)9-18(42)34-21-22(43)23(47-26(30)45)16(11-38)46-25(21)37-27-35-19-15(40)10-33-24(44)20(19)36-27/h13-16,19-23,25,38,40,43H,2-11,28-29H2,1H3,(H2,30,45)(H,31,39)(H,32,41)(H,33,44)(H,34,42)(H2,35,36,37)
• InChIKey: JDQFOZPWCISXRD-UHFFFAOYSA-N

Properties

• Density: 1.707g/cm³ (Cal.)