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CHEBI:127566 - [(8S,9R,10R)-9-(4-pent-1-ynylphenyl)-6-propyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

ChEBI IDCHEBI:127566
ChEBI Name[(8S,9R,10R)-9-(4-pent-1-ynylphenyl)-6-propyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol
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DownloadsMolfile
FormulaC23H34N2O
Net Charge0
Average Mass354.538
Monoisotopic Mass354.26711
SMILESCCCC#Cc1ccc([C@@H]2[C@H]3CN(CCC)CCCCN3[C@H]2CO)cc1
InChIInChI=1S/C23H34N2O/c1-3-5-6-9-19-10-12-20(13-11-19)23-21-17-24(14-4-2)15-7-8-16-25(21)22(23)18-26/h10-13,21-23,26H,3-5,7-8,14-18H2,1-2H3/t21-,22+,23-/m1/s1
InChIKeyKTODDQQJQJDFIW-XPWALMASSA-N
ChEBI Ontology
Outgoing Relation(s)
[(8S,9R,10R)-9-(4-pent-1-ynylphenyl)-6-propyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:127566) is a azetidines (CHEBI:38777)
[(8S,9R,10R)-9-(4-pent-1-ynylphenyl)-6-propyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:127566) is a benzenes (CHEBI:22712)
[(8S,9R,10R)-9-(4-pent-1-ynylphenyl)-6-propyl-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol (CHEBI:127566) is a ring assembly (CHEBI:36820)
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