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CHEBI:126200 - (6S,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:126200
ChEBI Name(6S,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC27H27FN2O2
Net Charge0
Average Mass430.523
Monoisotopic Mass430.20566
SMILESCc1ccc(CN2CC(=O)N3[C@H](C2)[C@@H](c2ccc(-c4ccccc4F)cc2)[C@@H]3CO)cc1
InChIInChI=1S/C27H27FN2O2/c1-18-6-8-19(9-7-18)14-29-15-24-27(25(17-31)30(24)26(32)16-29)21-12-10-20(11-13-21)22-4-2-3-5-23(22)28/h2-13,24-25,27,31H,14-17H2,1H3/t24-,25+,27-/m1/s1
InChIKeyMTLIKKOEYLZGAR-CMTIAEDTSA-N
ChEBI Ontology
Outgoing Relation(s)
(6S,7R,8R)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-4-[(4-methylphenyl)methyl]-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:126200) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-37767LINCS