(3S,alphar)-3-[[(R)-Amino(4-Hydroxyphenyl)Acetyl]Amino]-alpha-(4-Hydroxyphenyl)-2-Oxo-1-Azetidineacetic Acid
[CAS# 65309-11-7]

Identification

• Name: (3S,alphar)-3-[[(R)-Amino(4-Hydroxyphenyl)Acetyl]Amino]-alpha-(4-Hydroxyphenyl)-2-Oxo-1-Azetidineacetic Acid
• Synonyms: (2R)-2-[(3S)-3-[[2-Amino-2-(4-Hydroxyphenyl)Acetyl]Amino]-2-Oxo-Azetidin-1-Yl]-2-(4-Hydroxyphenyl)Acetic Acid; (2R)-2-[(3S)-3-[[2-Amino-2-(4-Hydroxyphenyl)-1-Oxoethyl]Amino]-2-Oxo-1-Azetidinyl]-2-(4-Hydroxyphenyl)Acetic Acid; (2R)-2-[(3S)-3-[[2-Amino-2-(4-Hydroxyphenyl)Acetyl]Amino]-2-Keto-Azetidin-1-Yl]-2-(4-Hydroxyphenyl)Acetic Acid
• Molecular Formula: C₁₉H₁₉N₃O₆
• Molecular Weight: 385.38
• CAS Registry Number: 65309-11-7
• SMILES: [C@@H]3(NC(=O)C(N)C1=CC=C(O)C=C1)C(=O)N([C@H](C2=CC=C(O)C=C2)C(=O)O)C3
• InChI: 1S/C19H19N3O6/c20-15(10-1-5-12(23)6-2-10)17(25)21-14-9-22(18(14)26)16(19(27)28)11-3-7-13(24)8-4-11/h1-8,14-16,23-24H,9,20H2,(H,21,25)(H,27,28)/t14-,15?,16+/m0/s1
• InChIKey: SAVAPYNOQXYBJS-DLDKDUQYSA-N

Properties

• Density: 1.558g/cm³ (Cal.)
• Boiling point: 808.824°C at 760 mmHg (Cal.)
• Flash point: 442.961°C (Cal.)