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CHEBI:129671 - [(8S,9S,10R)-6-[(3-methoxyphenyl)methyl]-9-[4-(3-pyridinyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

ChEBI IDCHEBI:129671
ChEBI Name[(8S,9S,10R)-6-[(3-methoxyphenyl)methyl]-9-[4-(3-pyridinyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
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DownloadsMolfile
FormulaC28H33N3O2
Net Charge0
Average Mass443.591
Monoisotopic Mass443.25728
SMILESCOc1cccc(CN2CCCCN3[C@H](C2)[C@H](c2ccc(-c4cccnc4)cc2)[C@@H]3CO)c1
InChIInChI=1S/C28H33N3O2/c1-33-25-8-4-6-21(16-25)18-30-14-2-3-15-31-26(19-30)28(27(31)20-32)23-11-9-22(10-12-23)24-7-5-13-29-17-24/h4-13,16-17,26-28,32H,2-3,14-15,18-20H2,1H3/t26-,27+,28+/m1/s1
InChIKeyKHWAIWRVNCDSPP-PKTNWEFCSA-N
ChEBI Ontology
Outgoing Relation(s)
[(8S,9S,10R)-6-[(3-methoxyphenyl)methyl]-9-[4-(3-pyridinyl)phenyl]-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:129671) is a phenylpyridine (CHEBI:38193)
Manual XrefsDatabases
LSM-41222LINCS