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CHEBI:126249 - (3aR,4R,9bS)-8-(1-cyclohexenyl)-N-(2,5-difluorophenyl)-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide

ChEBI IDCHEBI:126249
ChEBI Name(3aR,4R,9bS)-8-(1-cyclohexenyl)-N-(2,5-difluorophenyl)-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide
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DownloadsMolfile
FormulaC26H29F2N3O2
Net Charge0
Average Mass453.533
Monoisotopic Mass453.22278
SMILESCN1c2ccc(C3=CCCCC3)cc2[C@@H]2[C@@H](CCN2C(=O)Nc2cc(F)ccc2F)[C@@H]1CO
InChIInChI=1S/C26H29F2N3O2/c1-30-23-10-7-17(16-5-3-2-4-6-16)13-20(23)25-19(24(30)15-32)11-12-31(25)26(33)29-22-14-18(27)8-9-21(22)28/h5,7-10,13-14,19,24-25,32H,2-4,6,11-12,15H2,1H3,(H,29,33)/t19-,24-,25-/m0/s1
InChIKeyPCTMECUMRLYFMY-LQGLAIQGSA-N
ChEBI Ontology
Outgoing Relation(s)
(3aR,4R,9bS)-8-(1-cyclohexenyl)-N-(2,5-difluorophenyl)-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide (CHEBI:126249) is a pyrroloquinoline (CHEBI:50918)
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