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CHEBI:98318 - (2S,3R,4S)-3-[4-(cyclohexen-1-yl)phenyl]-1-(3-fluorobenzoyl)-4-(hydroxymethyl)azetidine-2-carbonitrile

ChEBI IDCHEBI:98318
ChEBI Name(2S,3R,4S)-3-[4-(cyclohexen-1-yl)phenyl]-1-(3-fluorobenzoyl)-4-(hydroxymethyl)azetidine-2-carbonitrile
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DownloadsMolfile
FormulaC24H23FN2O2
Net Charge0
Average Mass390.458
Monoisotopic Mass390.17436
SMILESN#C[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)c1cccc(F)c1
InChIInChI=1S/C24H23FN2O2/c25-20-8-4-7-19(13-20)24(29)27-21(14-26)23(22(27)15-28)18-11-9-17(10-12-18)16-5-2-1-3-6-16/h4-5,7-13,21-23,28H,1-3,6,15H2/t21-,22-,23-/m1/s1
InChIKeyBSEGMNXKWUIHHS-DNVJHFABSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3R,4S)-3-[4-(cyclohexen-1-yl)phenyl]-1-(3-fluorobenzoyl)-4-(hydroxymethyl)azetidine-2-carbonitrile (CHEBI:98318) is a azetidines (CHEBI:38777)
(2S,3R,4S)-3-[4-(cyclohexen-1-yl)phenyl]-1-(3-fluorobenzoyl)-4-(hydroxymethyl)azetidine-2-carbonitrile (CHEBI:98318) is a benzenes (CHEBI:22712)
(2S,3R,4S)-3-[4-(cyclohexen-1-yl)phenyl]-1-(3-fluorobenzoyl)-4-(hydroxymethyl)azetidine-2-carbonitrile (CHEBI:98318) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-9697LINCS