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CHEBI:125852 - (6S,7R,8R)-7-(4-bromophenyl)-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:125852
ChEBI Name(6S,7R,8R)-7-(4-bromophenyl)-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC13H15BrN2O2
Net Charge0
Average Mass311.179
Monoisotopic Mass310.03169
SMILESO=C1CNC[C@@H]2[C@@H](c3ccc(Br)cc3)[C@H](CO)N12
InChIInChI=1S/C13H15BrN2O2/c14-9-3-1-8(2-4-9)13-10-5-15-6-12(18)16(10)11(13)7-17/h1-4,10-11,13,15,17H,5-7H2/t10-,11+,13-/m1/s1
InChIKeyCPZPDKPINUWRBY-NTZNESFSSA-N
ChEBI Ontology
Outgoing Relation(s)
(6S,7R,8R)-7-(4-bromophenyl)-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:125852) is a azetidines (CHEBI:38777)
(6S,7R,8R)-7-(4-bromophenyl)-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:125852) is a benzenes (CHEBI:22712)
(6S,7R,8R)-7-(4-bromophenyl)-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:125852) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-37419LINCS