(2R)-2-Amino-4-[4-[N-Hydroxy-C-[[(3S)-1-[(1R)-2-Hydroxy-1-(4-Hydroxyphenyl)-2-Oxoethyl]-2-Oxoazetidin-3-Yl]Carbamoyl]Carbonimidoyl]Phenoxy]Butanoic Acid
[CAS# 39391-39-4]

Identification

• Name: (2R)-2-Amino-4-[4-[N-Hydroxy-C-[[(3S)-1-[(1R)-2-Hydroxy-1-(4-Hydroxyphenyl)-2-Oxoethyl]-2-Oxoazetidin-3-Yl]Carbamoyl]Carbonimidoyl]Phenoxy]Butanoic Acid
• Synonyms: (2R)-2-Amino-4-[4-[N-Hydroxy-C-[[(3S)-1-[(1R)-2-Hydroxy-1-(4-Hydroxyphenyl)-2-Oxo-Ethyl]-2-Oxo-Azetidin-3-Yl]Carbamoyl]Carbonimidoyl]Phenoxy]Butanoic Acid; (2R)-2-Amino-4-[4-[(1Z)-2-[[(3S)-1-[(1R)-2-Hydroxy-1-(4-Hydroxyphenyl)-2-Oxoethyl]-2-Oxo-3-Azetidinyl]Amino]-1-Hydroxyimino-2-Oxoethyl]Phenoxy]Butanoic Acid; (2R)-2-Amino-4-[4-[2-[[(3S)-1-[(1R)-2-Hydroxy-1-(4-Hydroxyphenyl)-2-Keto-Ethyl]-2-Keto-Azetidin-3-Yl]Amino]-2-Keto-Acetohydroximoyl]Phenoxy]Butyric Acid
• Molecular Formula: C₂₃H₂₄N₄O₉
• Molecular Weight: 500.46
• CAS Registry Number: 39391-39-4
• SMILES: [C@@H]1(CN(C1=O)[C@@H](C(=O)O)C2=CC=C(O)C=C2)NC(C(=N/O)\C3=CC=C(OCC[C@H](C(=O)O)N)C=C3)=O
• InChI: 1S/C23H24N4O9/c24-16(22(31)32)9-10-36-15-7-3-12(4-8-15)18(26-35)20(29)25-17-11-27(21(17)30)19(23(33)34)13-1-5-14(28)6-2-13/h1-8,16-17,19,28,35H,9-11,24H2,(H,25,29)(H,31,32)(H,33,34)/b26-18-/t16-,17+,19-/m1/s1
• InChIKey: CTNZOGJNVIFEBA-UPSUJEDGSA-N

Properties

• Density: 1.571g/cm³ (Cal.)

References

• (1): Hodgson Simon T., Hollinshead David M., Ley Steven V., Low Caroline M. R., Williams David J.. Use of ?-allyltricarbonyliron lactam complexes in the preparation of nocardicin derivatives: synthesis of (?)-3-oxo-1-[(p-benzyloxyphenyl)-benzyloxycarbonylmethyl]azetidin-2-one, Journal of the Chemical Society, Perkin Transactions 1, 1985