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CHEBI:126178 - (2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

ChEBI IDCHEBI:126178
ChEBI Name(2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile
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FormulaC16H18N2O
Net Charge0
Average Mass254.333
Monoisotopic Mass254.14191
SMILESN#C[C@H]1N[C@H](CO)[C@H]1c1ccc(C2=CCCC2)cc1
InChIInChI=1S/C16H18N2O/c17-9-14-16(15(10-19)18-14)13-7-5-12(6-8-13)11-3-1-2-4-11/h3,5-8,14-16,18-19H,1-2,4,10H2/t14-,15-,16+/m1/s1
InChIKeyLOVFADHEILTMJX-OAGGEKHMSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile (CHEBI:126178) is a azetidines (CHEBI:38777)
(2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile (CHEBI:126178) is a benzenes (CHEBI:22712)
(2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile (CHEBI:126178) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-37745LINCS