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CHEBI:130577 - (6S,7S,8S)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-4-[oxo(pyridin-4-yl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:130577
ChEBI Name(6S,7S,8S)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-4-[oxo(pyridin-4-yl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC26H25N3O3
Net Charge0
Average Mass427.504
Monoisotopic Mass427.18959
SMILESCc1ccccc1-c1ccc([C@@H]2[C@@H](CO)N3C(=O)CN(C(=O)c4ccncc4)C[C@H]23)cc1
InChIInChI=1S/C26H25N3O3/c1-17-4-2-3-5-21(17)18-6-8-19(9-7-18)25-22-14-28(15-24(31)29(22)23(25)16-30)26(32)20-10-12-27-13-11-20/h2-13,22-23,25,30H,14-16H2,1H3/t22-,23-,25+/m1/s1
InChIKeyLURUAEVVSCDZBN-OYRHQHFDSA-N
ChEBI Ontology
Outgoing Relation(s)
(6S,7S,8S)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-4-[oxo(pyridin-4-yl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:130577) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-42126LINCS