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CHEBI:129129 - 3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:129129
ChEBI Name3-[4-[(8R,9R,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)c1cccc(-c2ccc([C@H]3[C@H](CO)N4CCCCN(CC5CCOCC5)C[C@@H]34)cc2)c1
InChIInChI=1S/C30H41N3O3/c1-31(2)30(35)26-7-5-6-25(18-26)23-8-10-24(11-9-23)29-27-20-32(19-22-12-16-36-17-13-22)14-3-4-15-33(27)28(29)21-34/h5-11,18,22,27-29,34H,3-4,12-17,19-21H2,1-2H3/t27-,28-,29+/m0/s1
InChIKeyHTOXPRASVGCNJV-YTCPBCGMSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-[(8R,9R,10R)-10-(hydroxymethyl)-6-(4-oxanylmethyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:129129) is a biphenyls (CHEBI:22888)
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