CHEBI:125033 - [(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-(4-oxanyl)methanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name [(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-(4-oxanyl)methanone
ChEBI ID CHEBI:125033
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C24H28N2O3
Net Charge 0
Average Mass 392.492
Monoisotopic Mass 392.20999
InChI InChI=1S/C24H28N2O3/c1-28-20-4-2-3-19(13-20)16-5-7-17(8-6-16)23-21-14-26(15-22(23)25-21)24(27)18-9-11-29-12-10-18/h2-8,13,18,21-23,25H,9-12,14-15H2,1H3/t21-,22+,23?
InChIKey AJBUMCZTMHNJAQ-AIZNXBIQSA-N
SMILES COC1=CC=CC(=C1)C2=CC=C(C=C2)C3[C@H]4CN(C[C@@H]3N4)C(=O)C5CCOCC5
ChEBI Ontology
Outgoing [(1S,5R)-7-[4-(3-methoxyphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-(4-oxanyl)methanone (CHEBI:125033) is a piperidines (CHEBI:26151)
Manual Xref Database
LSM-36495 LINCS
View more database links