Lactoylpepstatin
[CAS# 82867-32-1]

Identification

• Name: Lactoylpepstatin
• Synonyms: (3S,4S)-3-Hydroxy-4-[[(2S)-2-[[(3S,4S)-3-Hydroxy-4-[[(2S)-2-[[(2S)-2-(2-Hydroxypropanoylamino)-3-Methyl-Butanoyl]Amino]-3-Methyl-Butanoyl]Amino]-6-Methyl-Heptanoyl]Amino]Propanoyl]Amino]-6-Methyl-Heptanoic Acid; (3S,4S)-3-Hydroxy-4-[[(2S)-2-[[(3S,4S)-3-Hydroxy-4-[[(2S)-2-[[(2S)-2-[(2-Hydroxy-1-Oxopropyl)Amino]-3-Methyl-1-Oxobutyl]Amino]-3-Methyl-1-Oxobutyl]Amino]-6-Methyl-1-Oxoheptyl]Amino]-1-Oxopropyl]Amino]-6-Methylheptanoic Acid; (3S,4S)-3-Hydroxy-4-[[(2S)-2-[[(3S,4S)-3-Hydroxy-4-[[(2S)-2-[[(2S)-2-Lactamido-3-Methyl-Butanoyl]Amino]-3-Methyl-Butanoyl]Amino]-6-Methyl-Heptanoyl]Amino]Propanoyl]Amino]-6-Methyl-Enanthic Acid
• Molecular Formula: C₃₂H₅₉N₅O₁₀
• Molecular Weight: 673.85
• CAS Registry Number: 82867-32-1
• SMILES: [C@@H](NC([C@@H](NC([C@@H](NC(C(C)O)=O)C(C)C)=O)C(C)C)=O)([C@H](CC(N[C@@H](C)C(N[C@H]([C@H](CC(O)=O)O)CC(C)C)=O)=O)O)CC(C)C
• InChI: 1S/C32H59N5O10/c1-15(2)11-21(35-31(46)27(17(5)6)37-32(47)28(18(7)8)36-30(45)20(10)38)23(39)13-25(41)33-19(9)29(44)34-22(12-16(3)4)24(40)14-26(42)43/h15-24,27-28,38-40H,11-14H2,1-10H3,(H,33,41)(H,34,44)(H,35,46)(H,36,45)(H,37,47)(H,42,43)/t19-,20?,21-,22-,23-,24-,27-,28-/m0/s1
• InChIKey: SGBATOYVQGIVGJ-AYYDESJSSA-N

Properties

• Density: 1.166g/cm³ (Cal.)
• Boiling point: 1021.37°C at 760 mmHg (Cal.)
• Flash point: 571.504°C (Cal.)