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CHEBI:125097 - (1R,5S)-3-(1,3-benzodioxol-5-ylmethyl)-7-[4-(3-pyridinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane

ChEBI IDCHEBI:125097
ChEBI Name(1R,5S)-3-(1,3-benzodioxol-5-ylmethyl)-7-[4-(3-pyridinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane
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FormulaC24H23N3O2
Net Charge0
Average Mass385.467
Monoisotopic Mass385.17903
SMILESc1cncc(-c2ccc(C3[C@@H]4CN(Cc5ccc6c(c5)OCO6)C[C@H]3N4)cc2)c1
InChIInChI=1S/C24H23N3O2/c1-2-19(11-25-9-1)17-4-6-18(7-5-17)24-20-13-27(14-21(24)26-20)12-16-3-8-22-23(10-16)29-15-28-22/h1-11,20-21,24,26H,12-15H2/t20-,21+,24?
InChIKeyWBGXRZPLVSELSO-SVGJNIJCSA-N
ChEBI Ontology
Outgoing Relation(s)
(1R,5S)-3-(1,3-benzodioxol-5-ylmethyl)-7-[4-(3-pyridinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane (CHEBI:125097) is a piperidines (CHEBI:26151)
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