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CHEBI:130408 - 3-[4-[(8S,9S,10S)-10-(hydroxymethyl)-6-(3,3,3-trifluoropropyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide

ChEBI IDCHEBI:130408
ChEBI Name3-[4-[(8S,9S,10S)-10-(hydroxymethyl)-6-(3,3,3-trifluoropropyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide
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DownloadsMolfile
FormulaC27H34F3N3O2
Net Charge0
Average Mass489.582
Monoisotopic Mass489.26031
SMILESCN(C)C(=O)c1cccc(-c2ccc([C@@H]3[C@@H](CO)N4CCCCN(CCC(F)(F)F)C[C@H]34)cc2)c1
InChIInChI=1S/C27H34F3N3O2/c1-31(2)26(35)22-7-5-6-21(16-22)19-8-10-20(11-9-19)25-23-17-32(15-12-27(28,29)30)13-3-4-14-33(23)24(25)18-34/h5-11,16,23-25,34H,3-4,12-15,17-18H2,1-2H3/t23-,24-,25+/m1/s1
InChIKeySUWVCNKGBWKVIR-SDHSZQHLSA-N
ChEBI Ontology
Outgoing Relation(s)
3-[4-[(8S,9S,10S)-10-(hydroxymethyl)-6-(3,3,3-trifluoropropyl)-1,6-diazabicyclo[6.2.0]decan-9-yl]phenyl]-N,N-dimethylbenzamide (CHEBI:130408) is a biphenyls (CHEBI:22888)
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