Compound ID | 888

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PGE 7119699

Class: Quinolonyl-carbacephem

Spectrum of activity: Gram-positive  &  Gram-negative
Details of activity: Active againsst S. aureus, Streptococcus pneumoniae, E. coli, Pseudomonas aeruginosa, Enterobacter cloacae
Description: quinolyl moiety linked covalently to a carbacephem via a carbamate or amine linkage
Institute where first reported: Procter Gamble Pharmaceuticals, Ireland
Year first mentioned: 1997
Highest developmental phase: Preclinical
Development status: Inactive
Chemical structure(s):
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Molecular weight: 743.78
Iso. SMILES: C[C@@H]([C@@H]1CCN(C1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)NC/C=C/C5=C(N6[C@H](CC5)[C@@H](C6=O)NC(=O)COC7=CC=CC=C7)C(=O)O
InChI Key: YXRPDSMLHDHCLD-ORLUZABISA-N
Can. SMILES: C[C@@H]([C@@H]1CCN(C1)C2=C(C3=C(C=C2F)C(=O)C(=CN3C4CC4)C(=O)O)OC)NC/C=C/C5=C(C(=O)O)N6[C@H](CC5)[C@@H](C6=O)NC(=O)COC7=CC=CC=C7
InChI: InChI=1S/C39H42FN5O9/c1-21(23-14-16-43(18-23)34-28(40)17-26-33(36(34)53-2)44(24-11-12-24)19-27(35(26)47)38(49)50)41-15-6-7-22-10-13-29-31(37(48)45(29)32(22)39(51)52)42-30(46)20-54-25-8-4-3-5-9-25/h3-9,17,19,21,23-24,29,31,41H,10-16,18,20H2,1-2H3,(H,42,46)(H,49,50)(H,51,52)/b7-6+/t21-,23+,29+,31-/m0/s1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/6474823
Citations:
  • https://www.ncbi.nlm.nih.gov/pubmed/10508732

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