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CHEBI:99885 - (2S,3S,4R)-1-[cyclopentyl(oxo)methyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile

ChEBI IDCHEBI:99885
ChEBI Name(2S,3S,4R)-1-[cyclopentyl(oxo)methyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
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FormulaC17H20N2O2
Net Charge0
Average Mass284.359
Monoisotopic Mass284.15248
SMILESN#C[C@@H]1[C@H](c2ccccc2)[C@H](CO)N1C(=O)C1CCCC1
InChIInChI=1S/C17H20N2O2/c18-10-14-16(12-6-2-1-3-7-12)15(11-20)19(14)17(21)13-8-4-5-9-13/h1-3,6-7,13-16,20H,4-5,8-9,11H2/t14-,15+,16+/m1/s1
InChIKeyRUNWFOIXOHBRTB-PMPSAXMXSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S,4R)-1-[cyclopentyl(oxo)methyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile (CHEBI:99885) is a azetidines (CHEBI:38777)
(2S,3S,4R)-1-[cyclopentyl(oxo)methyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile (CHEBI:99885) is a benzenes (CHEBI:22712)
(2S,3S,4R)-1-[cyclopentyl(oxo)methyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile (CHEBI:99885) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-11264LINCS