CHEBI:129062 - [(1R,2aS,8bS)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-1-yl]methanol

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ChEBI Name [(1R,2aS,8bS)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-1-yl]methanol ChEBI ID CHEBI:129062 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C25H23FN2O5S Net Charge 0 Average Mass 482.526 Monoisotopic Mass 482.13117 InChI InChI=1S/C25H23FN2O5S/c26-17-6-8-18(9-7-17)34(30,31)28-13-21-25(19-3-1-2-4-20(19)28)22(14-29)27(21)12-16-5-10-23-24(11-16)33-15-32-23/h1-11,21-22,25,29H,12-15H2/t21-,22+,25+/m1/s1 InChIKey LVICBAVDXUVLQS-SLSDLSHTSA-N SMILES C1[C@@H]2[C@@H]([C@@H](N2CC3=CC4=C(C=C3)OCO4)CO)C5=CC=CC=C5N1S(=O)(=O)C6=CC=C(C=C6)F Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) View more via ChEBI Ontology ChEBI Ontology Outgoing [(1R,2aS,8bS)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-fluorophenyl)sulfonyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-1-yl]methanol (CHEBI:129062) is a aminoquinoline (CHEBI:36709) Manual Xref Database LSM-40614 LINCS View more database links