CHEBI:125071 - 1-[(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-2-pyridin-4-ylethanone

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ChEBI Name 1-[(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-2-pyridin-4-ylethanone
ChEBI ID CHEBI:125071
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H25N3O2
Net Charge 0
Average Mass 399.486
Monoisotopic Mass 399.19468
InChI InChI=1S/C25H25N3O2/c1-30-21-4-2-3-20(14-21)18-5-7-19(8-6-18)25-22-15-28(16-23(25)27-22)24(29)13-17-9-11-26-12-10-17/h2-12,14,22-23,25,27H,13,15-16H2,1H3/t22-,23+,25?
InChIKey HNVPMDBINPMNDO-HCGNOCCLSA-N
SMILES COC1=CC=CC(=C1)C2=CC=C(C=C2)C3[C@H]4CN(C[C@@H]3N4)C(=O)CC5=CC=NC=C5
ChEBI Ontology
Outgoing 1-[(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-2-pyridin-4-ylethanone (CHEBI:125071) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-36533 LINCS
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