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CHEBI:128658 - [(3aS,4S,9bS)-8-bromo-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(2-fluorophenyl)methanone

ChEBI IDCHEBI:128658
ChEBI Name[(3aS,4S,9bS)-8-bromo-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(2-fluorophenyl)methanone
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FormulaC19H18BrFN2O2
Net Charge0
Average Mass405.267
Monoisotopic Mass404.05357
SMILESO=C(c1ccccc1F)N1CC[C@@H]2[C@H]1c1cc(Br)ccc1N[C@@H]2CO
InChIInChI=1S/C19H18BrFN2O2/c20-11-5-6-16-14(9-11)18-13(17(10-24)22-16)7-8-23(18)19(25)12-3-1-2-4-15(12)21/h1-6,9,13,17-18,22,24H,7-8,10H2/t13-,17+,18-/m0/s1
InChIKeyFVYMDQNVOKPIEP-VHSSKADRSA-N
ChEBI Ontology
Outgoing Relation(s)
[(3aS,4S,9bS)-8-bromo-4-(hydroxymethyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(2-fluorophenyl)methanone (CHEBI:128658) is a pyrroloquinoline (CHEBI:50918)
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