(2S,5R,6R)-6-[(4-Hydroxy-3,5-Diiodo-Benzoyl)Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
[CAS# 94887-73-7]

Identification

• Name: (2S,5R,6R)-6-[(4-Hydroxy-3,5-Diiodo-Benzoyl)Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid
• Synonyms: (2S,5R,6R)-6-[(4-Hydroxy-3,5-Diiodo-Benzoyl)Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (2S,5R,6R)-6-[[(4-Hydroxy-3,5-Diiodophenyl)-Oxomethyl]Amino]-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo[3.2.0]Heptane-2-Carboxylic Acid; (
• Molecular Formula: C₁₅H₁₄I₂N₂O₅S
• Molecular Weight: 588.16
• CAS Registry Number: 94887-73-7
• SMILES: [C@H]1(N2[C@H](SC1(C)C)[C@@H](C2=O)NC(C3=CC(=C(C(=C3)I)O)I)=O)C(=O)O
• InChI: 1S/C15H14I2N2O5S/c1-15(2)10(14(23)24)19-12(22)8(13(19)25-15)18-11(21)5-3-6(16)9(20)7(17)4-5/h3-4,8,10,13,20H,1-2H3,(H,18,21)(H,23,24)/t8-,10+,13-/m1/s1
• InChIKey: NBUBLMPREAGKRH-DFAYQTQMSA-N