Esterastin
[CAS# 67655-93-0]

Identification

• Name: Esterastin
• Synonyms: 1-(3-Hexyl-4-Oxooxetan-2-Yl)Trideca-4,7-Dien-2-Yl 2-Acetamido-4-Amino-4-Oxobutanoate; 1-[(3-Hexyl-4-Oxo-Oxetan-2-Yl)Methyl]Dodeca-3,6-Dienyl 2-Acetamido-4-Amino-4-Oxo-Butanoate; [(3E,6E)-1-[(3-Hexyl-4-Oxo-Oxetan-2-Yl)Methyl]Dodeca-3,6-Dienyl] 2-Acetamido-4-Amino-4-Oxo-Butanoate
• Molecular Formula: C₂₈H₄₆N₂O₆
• Molecular Weight: 506.68
• CAS Registry Number: 67655-93-0
• SMILES: C(C1OC(=O)C1CCCCCC)C(OC(=O)C(NC(=O)C)CC(=O)N)C\C=C\C\C=C\CCCCC
• InChI: 1S/C28H46N2O6/c1-4-6-8-10-11-12-13-14-15-17-22(35-28(34)24(20-26(29)32)30-21(3)31)19-25-23(27(33)36-25)18-16-9-7-5-2/h11-12,14-15,22-25H,4-10,13,16-20H2,1-3H3,(H2,29,32)(H,30,31)/b12-11+,15-14+
• InChIKey: JKNGELGDDBUFHG-TVYVBBRWSA-N