CHEBI:129406 - [(1S,2aS,8bS)-4-(3-methylphenyl)sulfonyl-2-(4-oxanylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-1-yl]methanol

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ChEBI Name [(1S,2aS,8bS)-4-(3-methylphenyl)sulfonyl-2-(4-oxanylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-1-yl]methanol ChEBI ID CHEBI:129406 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 C24H30N2O4S Net Charge 0 Average Mass 442.573 Monoisotopic Mass 442.19263 InChI InChI=1S/C24H30N2O4S/c1-17-5-4-6-19(13-17)31(28,29)26-15-22-24(20-7-2-3-8-21(20)26)23(16-27)25(22)14-18-9-11-30-12-10-18/h2-8,13,18,22-24,27H,9-12,14-16H2,1H3/t22-,23-,24+/m1/s1 InChIKey YBPZQQJGQWVWGL-SMIHKQSGSA-N SMILES CC1=CC(=CC=C1)S(=O)(=O)N2C[C@@H]3[C@@H]([C@H](N3CC4CCOCC4)CO)C5=CC=CC=C52 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 [(1S,2aS,8bS)-4-(3-methylphenyl)sulfonyl-2-(4-oxanylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-1-yl]methanol (CHEBI:129406) is a aminoquinoline (CHEBI:36709) Manual Xref Database LSM-40957 LINCS View more database links