CHEBI:127018 - (1S,2aR,8bR)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinoline-2-carboxamide

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ChEBI Name (1S,2aR,8bR)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinoline-2-carboxamide
ChEBI ID CHEBI:127018
Stars This entity has been manually annotated by a third party.
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Formula C18H18FN3O2
Net Charge 0
Average Mass 327.354
Monoisotopic Mass 327.13830
InChI InChI=1S/C18H18FN3O2/c19-11-5-7-12(8-6-11)21-18(24)22-15-9-20-14-4-2-1-3-13(14)17(15)16(22)10-23/h1-8,15-17,20,23H,9-10H2,(H,21,24)/t15-,16+,17+/m0/s1
InChIKey ZANRKKPBGNDREH-GVDBMIGSSA-N
SMILES C1[C@H]2[C@H]([C@H](N2C(=O)NC3=CC=C(C=C3)F)CO)C4=CC=CC=C4N1
ChEBI Ontology
Outgoing (1S,2aR,8bR)-N-(4-fluorophenyl)-1-(hydroxymethyl)-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinoline-2-carboxamide (CHEBI:127018) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-38581 LINCS
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