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CHEBI:126390 - [(8R,9S,10S)-9-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

ChEBI IDCHEBI:126390
ChEBI Name[(8R,9S,10S)-9-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
Stars
DownloadsMolfile
FormulaC29H35FN2O2
Net Charge0
Average Mass462.609
Monoisotopic Mass462.26826
SMILESOC[C@@H]1[C@@H](c2ccc(C#Cc3ccccc3F)cc2)[C@@H]2CN(CC3CCOCC3)CCCCN12
InChIInChI=1S/C29H35FN2O2/c30-26-6-2-1-5-24(26)10-7-22-8-11-25(12-9-22)29-27-20-31(19-23-13-17-34-18-14-23)15-3-4-16-32(27)28(29)21-33/h1-2,5-6,8-9,11-12,23,27-29,33H,3-4,13-21H2/t27-,28+,29-/m0/s1
InChIKeyCUZIWLSYIOFIPC-NHKHRBQYSA-N
ChEBI Ontology
Outgoing Relation(s)
[(8R,9S,10S)-9-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:126390) is a azetidines (CHEBI:38777)
[(8R,9S,10S)-9-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:126390) is a benzenes (CHEBI:22712)
[(8R,9S,10S)-9-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:126390) is a ring assembly (CHEBI:36820)
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