2-[[2-Amino-3-Hydroxy-3-[(3R,5S)-7-Oxo-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propanoyl]Amino]-3-Hydroxy-3-[(3R,5S)-7-Oxo-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propanoic Acid
[CAS# 103059-93-4]

Identification

• Name: 2-[[2-Amino-3-Hydroxy-3-[(3R,5S)-7-Oxo-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propanoyl]Amino]-3-Hydroxy-3-[(3R,5S)-7-Oxo-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propanoic Acid
• Synonyms: 2-[[2-Amino-3-Hydroxy-1-Oxo-3-[(3R,5S)-7-Oxo-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propyl]Amino]-3-Hydroxy-3-[(3R,5S)-7-Oxo-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propanoic Acid; 2-[[2-Amino-3-Hydroxy-3-[(3R,5S)-7-Keto-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propanoyl]Amino]-3-Hydroxy-3-[(3R,5S)-7-Keto-4-Oxa-1-Azabicyclo[3.2.0]Heptan-3-Yl]Propionic Acid; C06667
• Molecular Formula: C₁₆H₂₂N₄O₉
• Molecular Weight: 414.37
• CAS Registry Number: 103059-93-4
• SMILES: [C@@H]12O[C@H](CN1C(=O)C2)C(O)C(NC(=O)C(N)C(O)[C@@H]4O[C@@H]3N(C(=O)C3)C4)C(O)=O
• InChI: 1S/C16H22N4O9/c17-11(13(23)5-3-19-7(21)1-9(19)28-5)15(25)18-12(16(26)27)14(24)6-4-20-8(22)2-10(20)29-6/h5-6,9-14,23-24H,1-4,17H2,(H,18,25)(H,26,27)/t5-,6-,9+,10+,11?,12?,13?,14?/m1/s1
• InChIKey: SAFJOTXIKNUGOJ-LNWOBJSJSA-N

Properties

• Density: 1.741g/cm³ (Cal.)
• Boiling point: 921.219°C at 760 mmHg (Cal.)
• Flash point: 510.935°C (Cal.)