(E,2R,3R,4S,5R)-3,4,5-Trihydroxy-2-Methoxy-8-Methyl-N-[(3S)-2-Oxoazepan-3-Yl]Non-6-Enamide
[CAS# 118477-03-5]

Identification

• Name: (E,2R,3R,4S,5R)-3,4,5-Trihydroxy-2-Methoxy-8-Methyl-N-[(3S)-2-Oxoazepan-3-Yl]Non-6-Enamide
• Synonyms: (E,2R,3R,4S,5R)-3,4,5-Trihydroxy-2-Methoxy-8-Methyl-N-[(3S)-2-Oxo-3-Azepanyl]Non-6-Enamide; (E,2R,3R,4S,5R)-3,4,5-Trihydroxy-N-[(3S)-2-Ketoazepan-3-Yl]-2-Methoxy-8-Methyl-Non-6-Enamide; Bengamide E
• Molecular Formula: C₁₇H₃₀N₂O₆
• Molecular Weight: 358.43
• CAS Registry Number: 118477-03-5
• SMILES: [C@H](C(N[C@@H]1C(NCCCC1)=O)=O)([C@@H]([C@H]([C@@H](/C=C/C(C)C)O)O)O)OC
• InChI: 1S/C17H30N2O6/c1-10(2)7-8-12(20)13(21)14(22)15(25-3)17(24)19-11-6-4-5-9-18-16(11)23/h7-8,10-15,20-22H,4-6,9H2,1-3H3,(H,18,23)(H,19,24)/b8-7+/t11-,12+,13-,14+,15+/m0/s1
• InChIKey: QBOZJYBWSKZELU-XMBAGFDESA-N