CHEBI:130058 - [(1S,2aR,8bR)-1-(hydroxymethyl)-2-methyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-fluorophenyl)methanone

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ChEBI Name [(1S,2aR,8bR)-1-(hydroxymethyl)-2-methyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-fluorophenyl)methanone
ChEBI ID CHEBI:130058
Stars This entity has been manually annotated by a third party.
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Formula C19H19FN2O2
Net Charge 0
Average Mass 326.365
Monoisotopic Mass 326.14306
InChI InChI=1S/C19H19FN2O2/c1-21-16-10-22(19(24)12-6-8-13(20)9-7-12)15-5-3-2-4-14(15)18(16)17(21)11-23/h2-9,16-18,23H,10-11H2,1H3/t16-,17+,18+/m0/s1
InChIKey YJFOHBYNLUUPSE-RCCFBDPRSA-N
SMILES CN1[C@H]2CN(C3=CC=CC=C3[C@H]2[C@H]1CO)C(=O)C4=CC=C(C=C4)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 )
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ChEBI Ontology
Outgoing [(1S,2aR,8bR)-1-(hydroxymethyl)-2-methyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-fluorophenyl)methanone (CHEBI:130058) is a aminoquinoline (CHEBI:36709)
Manual Xref Database
LSM-41609 LINCS
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