CHEBI:130916 - (2S,3S,4S)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile

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ChEBI Name (2S,3S,4S)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile
ChEBI ID CHEBI:130916
Stars This entity has been manually annotated by a third party.
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Formula C23H29N3O3
Net Charge 0
Average Mass 395.496
Monoisotopic Mass 395.22089
InChI InChI=1S/C23H29N3O3/c24-14-20-23(19-8-6-18(7-9-19)17-4-2-1-3-5-17)21(16-27)26(20)22(28)15-25-10-12-29-13-11-25/h4,6-9,20-21,23,27H,1-3,5,10-13,15-16H2/t20-,21-,23+/m1/s1
InChIKey FZARLNUCAVCJAO-XPNTWCBSSA-N
SMILES C1CCC(=CC1)C2=CC=C(C=C2)[C@@H]3[C@H](N([C@@H]3C#N)C(=O)CN4CCOCC4)CO
ChEBI Ontology
Outgoing (2S,3S,4S)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile (CHEBI:130916) is a azetidines (CHEBI:38777)
(2S,3S,4S)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile (CHEBI:130916) is a benzenes (CHEBI:22712)
(2S,3S,4S)-3-[4-(1-cyclohexenyl)phenyl]-4-(hydroxymethyl)-1-[2-(4-morpholinyl)-1-oxoethyl]-2-azetidinecarbonitrile (CHEBI:130916) is a ring assembly (CHEBI:36820)
Manual Xref Database
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