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CHEBI:128767 - 4-[4-[(8R,9S,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:128767
ChEBI Name4-[4-[(8R,9S,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide
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DownloadsMolfile
FormulaC30H41N3O3
Net Charge0
Average Mass491.676
Monoisotopic Mass491.31479
SMILESCN(C)C(=O)c1ccc(-c2ccc([C@@H]3[C@H](CO)N4CCCCN(CC5CCOCC5)C[C@@H]34)cc2)cc1
InChIInChI=1S/C30H41N3O3/c1-31(2)30(35)26-11-7-24(8-12-26)23-5-9-25(10-6-23)29-27-20-32(19-22-13-17-36-18-14-22)15-3-4-16-33(27)28(29)21-34/h5-12,22,27-29,34H,3-4,13-21H2,1-2H3/t27-,28-,29-/m0/s1
InChIKeyIBKPXPSBRQEHJZ-AWCRTANDSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[4-[(8R,9S,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:128767) is a biphenyls (CHEBI:22888)
Manual XrefsDatabases
LSM-40320LINCS