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CHEBI:120819 - (5R)-5-tert-butyl-1-[(3S)-3-phenyl-3-(phenylthio)propyl]-2-azepanone

ChEBI IDCHEBI:120819
ChEBI Name(5R)-5-tert-butyl-1-[(3S)-3-phenyl-3-(phenylthio)propyl]-2-azepanone
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FormulaC25H33NOS
Net Charge0
Average Mass395.612
Monoisotopic Mass395.22829
SMILESCC(C)(C)[C@@H]1CCC(=O)N(CC[C@H](Sc2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C25H33NOS/c1-25(2,3)21-14-15-24(27)26(18-16-21)19-17-23(20-10-6-4-7-11-20)28-22-12-8-5-9-13-22/h4-13,21,23H,14-19H2,1-3H3/t21-,23+/m1/s1
InChIKeyUODHBKAFNBRALE-GGAORHGYSA-N
ChEBI Ontology
Outgoing Relation(s)
(5R)-5-tert-butyl-1-[(3S)-3-phenyl-3-(phenylthio)propyl]-2-azepanone (CHEBI:120819) is a caprolactams (CHEBI:23000)
Manual XrefsDatabases
LSM-32262LINCS