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CHEBI:126893 - 4-[(3aR,4R,9bR)-1-[cyclohexyl(oxo)methyl]-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile

ChEBI IDCHEBI:126893
ChEBI Name4-[(3aR,4R,9bR)-1-[cyclohexyl(oxo)methyl]-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile
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DownloadsMolfile
FormulaC26H29N3O2
Net Charge0
Average Mass415.537
Monoisotopic Mass415.22598
SMILESN#Cc1ccc(-c2ccc3c(c2)[C@H]2[C@H](CCN2C(=O)C2CCCCC2)[C@H](CO)N3)cc1
InChIInChI=1S/C26H29N3O2/c27-15-17-6-8-18(9-7-17)20-10-11-23-22(14-20)25-21(24(16-30)28-23)12-13-29(25)26(31)19-4-2-1-3-5-19/h6-11,14,19,21,24-25,28,30H,1-5,12-13,16H2/t21-,24+,25-/m1/s1
InChIKeyRPJFVTCWZHMVQZ-IEZKXTBUSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[(3aR,4R,9bR)-1-[cyclohexyl(oxo)methyl]-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-8-yl]benzonitrile (CHEBI:126893) is a quinolines (CHEBI:26513)
Manual XrefsDatabases
LSM-38456LINCS