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CHEBI:128692 - (6S,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:128692
ChEBI Name(6S,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC25H22FN3O3
Net Charge0
Average Mass431.467
Monoisotopic Mass431.16452
SMILESO=C(c1cccnc1)N1CC(=O)N2[C@H](CO)[C@@H](c3ccc(-c4ccccc4F)cc3)[C@H]2C1
InChIInChI=1S/C25H22FN3O3/c26-20-6-2-1-5-19(20)16-7-9-17(10-8-16)24-21-13-28(14-23(31)29(21)22(24)15-30)25(32)18-4-3-11-27-12-18/h1-12,21-22,24,30H,13-15H2/t21-,22-,24+/m1/s1
InChIKeyCSXAVIOBTDLUSY-AKFKNWHVSA-N
ChEBI Ontology
Outgoing Relation(s)
(6S,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:128692) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-40246LINCS