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CHEBI:127193 - (6R,7S,8S)-7-(4-bromophenyl)-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one

ChEBI IDCHEBI:127193
ChEBI Name(6R,7S,8S)-7-(4-bromophenyl)-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one
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DownloadsMolfile
FormulaC14H17BrN2O4S
Net Charge0
Average Mass389.271
Monoisotopic Mass388.00924
SMILESCS(=O)(=O)N1CC(=O)N2[C@H](CO)[C@@H](c3ccc(Br)cc3)[C@@H]2C1
InChIInChI=1S/C14H17BrN2O4S/c1-22(20,21)16-6-11-14(9-2-4-10(15)5-3-9)12(8-18)17(11)13(19)7-16/h2-5,11-12,14,18H,6-8H2,1H3/t11-,12+,14-/m0/s1
InChIKeyCWJBQADCDQSGJH-SCRDCRAPSA-N
ChEBI Ontology
Outgoing Relation(s)
(6R,7S,8S)-7-(4-bromophenyl)-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:127193) is a azetidines (CHEBI:38777)
(6R,7S,8S)-7-(4-bromophenyl)-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:127193) is a benzenes (CHEBI:22712)
(6R,7S,8S)-7-(4-bromophenyl)-8-(hydroxymethyl)-4-methylsulfonyl-1,4-diazabicyclo[4.2.0]octan-2-one (CHEBI:127193) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-38753LINCS