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CHEBI:128979 - 3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-[1-oxo-2-(3-pyridinyl)ethyl]-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]benzonitrile

ChEBI IDCHEBI:128979
ChEBI Name3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-[1-oxo-2-(3-pyridinyl)ethyl]-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]benzonitrile
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DownloadsMolfile
FormulaC29H30N4O2
Net Charge0
Average Mass466.585
Monoisotopic Mass466.23688
SMILESN#Cc1cccc(-c2ccc([C@H]3[C@H](CO)N4CCCCN(C(=O)Cc5cccnc5)C[C@@H]34)cc2)c1
InChIInChI=1S/C29H30N4O2/c30-17-21-5-3-7-25(15-21)23-8-10-24(11-9-23)29-26-19-32(13-1-2-14-33(26)27(29)20-34)28(35)16-22-6-4-12-31-18-22/h3-12,15,18,26-27,29,34H,1-2,13-14,16,19-20H2/t26-,27-,29+/m0/s1
InChIKeyUKOKPPMQFUSFQI-HPUNYJORSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-[1-oxo-2-(3-pyridinyl)ethyl]-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]benzonitrile (CHEBI:128979) is a biphenyls (CHEBI:22888)
3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-[1-oxo-2-(3-pyridinyl)ethyl]-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]benzonitrile (CHEBI:128979) is a nitrile (CHEBI:18379)
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