CHEBI:126918 - (6S,7R,8R)-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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ChEBI Name (6S,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
ChEBI ID CHEBI:126918
Stars This entity has been manually annotated by a third party.
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Formula C25H22FN3O3
Net Charge 0
Average Mass 431.460
Monoisotopic Mass 431.16452
InChI InChI=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
InChIKey CSXAVIOBTDLUSY-AOHZBQACSA-N
SMILES C1[C@@H]2[C@H]([C@@H](N2C(=O)CN1C(=O)C3=CN=CC=C3)CO)C4=CC=C(C=C4)C5=CC=CC=C5F
ChEBI Ontology
Outgoing (6S,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:126918) is a biphenyls (CHEBI:22888)
Manual Xref Database
LSM-38481 LINCS
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