Murabutide
[CAS# 74817-61-1]

Identification

• Name: Murabutide
• Synonyms: Butyl (2R)-2-[[(2R)-2-[[(2S)-2-[3-Acetamido-2,5-Dihydroxy-6-(Hydroxymethyl)Tetrahydropyran-4-Yl]Oxypropanoyl]Amino]Propanoyl]Amino]-5-Amino-5-Oxo-Pentanoate; (2R)-2-[[(2R)-2-[[(2S)-2-[[3-Acetamido-2,5-Dihydroxy-6-(Hydroxymethyl)-4-Tetrahydropyranyl]Oxy]-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-5-Amino-5-Oxopentanoic Acid Butyl Ester; (2R)-2-[[(2R)-2-[[(2S)-2-(3-Acetamido-2,5-Dihydroxy-6-Methylol-Tetrahydropyran-4-Yl)Oxypropanoyl]Amino]Propanoyl]Amino]-5-Amino-5-Keto-Valeric Acid Butyl Ester
• Molecular Formula: C₂₃H₄₀N₄O₁₁
• Molecular Weight: 548.59
• CAS Registry Number: 74817-61-1
• SMILES: [C@@H](OC1C(NC(=O)C)C(OC(C1O)CO)O)(C(=O)N[C@@H](C(=O)N[C@@H](C(OCCCC)=O)CCC(=O)N)C)C
• InChI: 1S/C23H40N4O11/c1-5-6-9-36-22(34)14(7-8-16(24)30)27-20(32)11(2)25-21(33)12(3)37-19-17(26-13(4)29)23(35)38-15(10-28)18(19)31/h11-12,14-15,17-19,23,28,31,35H,5-10H2,1-4H3,(H2,24,30)(H,25,33)(H,26,29)(H,27,32)/t11-,12+,14-,15?,17?,18?,19?,23?/m1/s1
• InChIKey: ZDSXRJABOCTJTD-MLRLIGJLSA-N