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CHEBI:129757 - (6S,7R,8R)-8-(hydroxymethyl)-7-[4-(3-methoxyphenyl)phenyl]-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:129757
ChEBI Name(6S,7R,8R)-8-(hydroxymethyl)-7-[4-(3-methoxyphenyl)phenyl]-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC26H25N3O4
Net Charge0
Average Mass443.503
Monoisotopic Mass443.18451
SMILESCOc1cccc(-c2ccc([C@@H]3[C@H]4CN(C(=O)c5cccnc5)CC(=O)N4[C@H]3CO)cc2)c1
InChIInChI=1S/C26H25N3O4/c1-33-21-6-2-4-19(12-21)17-7-9-18(10-8-17)25-22-14-28(15-24(31)29(22)23(25)16-30)26(32)20-5-3-11-27-13-20/h2-13,22-23,25,30H,14-16H2,1H3/t22-,23+,25-/m1/s1
InChIKeyREQXYHQUJXPQQP-GIFXNVAJSA-N
ChEBI Ontology
Outgoing Relation(s)
(6S,7R,8R)-8-(hydroxymethyl)-7-[4-(3-methoxyphenyl)phenyl]-4-[oxo(3-pyridinyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:129757) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-41308LINCS