Chlorocardicin
[CAS# 95927-71-2]

Identification

• Name: Chlorocardicin
• Synonyms: (2R)-2-Amino-4-[4-[C-[[(3S)-1-[(1R)-1-(3-Chloro-4-Hydroxy-Phenyl)-2-Hydroxy-2-Oxo-Ethyl]-2-Oxo-Azetidin-3-Yl]Carbamoyl]-N-Hydroxy-Carbonimidoyl]Phenoxy]Butanoic Acid; (2R)-2-Amino-4-[4-[(1E)-2-[[(3S)-1-[(1R)-1-(3-Chloro-4-Hydroxyphenyl)-2-Hydroxy-2-Oxoethy
• Molecular Formula: C₂₃H₂₃ClN₄O₉
• Molecular Weight: 534.91
• CAS Registry Number: 95927-71-2
• SMILES: [C@@H](N2C(=O)[C@@H](NC(=O)C(=N/O)/C1=CC=C(OCC[C@@H](N)C(=O)O)C=C1)C2)(C3=CC=C(O)C(=C3)Cl)C(=O)O
• InChI: 1S/C23H23ClN4O9/c24-14-9-12(3-6-17(14)29)19(23(34)35)28-10-16(21(28)31)26-20(30)18(27-36)11-1-4-13(5-2-11)37-8-7-15(25)22(32)33/h1-6,9,15-16,19,29,36H,7-8,10,25H2,(H,26,30)(H,32,33)(H,34,35)/b27-18+/t15-,16+,19-/m1/s1
• InChIKey: UMDAIHWMUXNVSB-IMUCLJOZSA-N

Properties

• Density: 1.632g/cm³ (Cal.)