CHEBI:128726 - 1-[(1S,2aR,8bR)-2-(benzenesulfonyl)-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 1-[(1S,2aR,8bR)-2-(benzenesulfonyl)-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone ChEBI ID CHEBI:128726 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 C25H24N2O4S Net Charge 0 Average Mass 448.536 Monoisotopic Mass 448.14568 InChI InChI=1S/C25H24N2O4S/c28-17-23-25-20-13-7-8-14-21(20)26(24(29)15-18-9-3-1-4-10-18)16-22(25)27(23)32(30,31)19-11-5-2-6-12-19/h1-14,22-23,25,28H,15-17H2/t22-,23+,25+/m0/s1 InChIKey JVDZBXYYJOYVHG-JBRSBNLGSA-N SMILES C1[C@H]2[C@H]([C@H](N2S(=O)(=O)C3=CC=CC=C3)CO)C4=CC=CC=C4N1C(=O)CC5=CC=CC=C5 ChEBI Ontology Outgoing 1-[(1S,2aR,8bR)-2-(benzenesulfonyl)-1-(hydroxymethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-phenylethanone (CHEBI:128726) is a quinolines (CHEBI:26513) Manual Xref Database LSM-40280 LINCS View more database links