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CHEBI:128273 - [(8S,9R,10S)-9-[4-(2-fluorophenyl)phenyl]-6-(5-pyrimidinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

ChEBI IDCHEBI:128273
ChEBI Name[(8S,9R,10S)-9-[4-(2-fluorophenyl)phenyl]-6-(5-pyrimidinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
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DownloadsMolfile
FormulaC26H29FN4O
Net Charge0
Average Mass432.543
Monoisotopic Mass432.23254
SMILESOC[C@@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@H]2CN(Cc3cncnc3)CCCCN12
InChIInChI=1S/C26H29FN4O/c27-23-6-2-1-5-22(23)20-7-9-21(10-8-20)26-24-16-30(15-19-13-28-18-29-14-19)11-3-4-12-31(24)25(26)17-32/h1-2,5-10,13-14,18,24-26,32H,3-4,11-12,15-17H2/t24-,25-,26-/m1/s1
InChIKeyXNSBVUHLLQGYEX-TWJOJJKGSA-N
ChEBI Ontology
Outgoing Relation(s)
[(8S,9R,10S)-9-[4-(2-fluorophenyl)phenyl]-6-(5-pyrimidinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:128273) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-39828LINCS