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CHEBI:126594 - [(3aR,4S,9bR)-8-(4-fluorophenyl)-1-(4-methoxyphenyl)sulfonyl-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol

ChEBI IDCHEBI:126594
ChEBI Name[(3aR,4S,9bR)-8-(4-fluorophenyl)-1-(4-methoxyphenyl)sulfonyl-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol
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DownloadsMolfile
FormulaC26H27FN2O4S
Net Charge0
Average Mass482.577
Monoisotopic Mass482.16756
SMILESCOc1ccc(S(=O)(=O)N2CC[C@@H]3[C@@H](CO)N(C)c4ccc(-c5ccc(F)cc5)cc4[C@@H]32)cc1
InChIInChI=1S/C26H27FN2O4S/c1-28-24-12-5-18(17-3-6-19(27)7-4-17)15-23(24)26-22(25(28)16-30)13-14-29(26)34(31,32)21-10-8-20(33-2)9-11-21/h3-12,15,22,25-26,30H,13-14,16H2,1-2H3/t22-,25-,26-/m1/s1
InChIKeyPQJWBSIFBZYFSG-DNRSQYFGSA-N
ChEBI Ontology
Outgoing Relation(s)
[(3aR,4S,9bR)-8-(4-fluorophenyl)-1-(4-methoxyphenyl)sulfonyl-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-4-yl]methanol (CHEBI:126594) is a quinolines (CHEBI:26513)
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