CHEBI:127481 - [(1S,2aR,8bR)-1-(hydroxymethyl)-2-(4-oxazolylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(3-fluorophenyl)methanone

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ChEBI Name [(1S,2aR,8bR)-1-(hydroxymethyl)-2-(4-oxazolylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(3-fluorophenyl)methanone
ChEBI ID CHEBI:127481
Stars This entity has been manually annotated by a third party.
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Formula C22H20FN3O3
Net Charge 0
Average Mass 393.412
Monoisotopic Mass 393.14887
InChI InChI=1S/C22H20FN3O3/c23-15-5-3-4-14(8-15)22(28)26-10-19-21(17-6-1-2-7-18(17)26)20(11-27)25(19)9-16-12-29-13-24-16/h1-8,12-13,19-21,27H,9-11H2/t19-,20+,21+/m0/s1
InChIKey LADYXEYYHNMFGT-PWRODBHTSA-N
SMILES C1[C@H]2[C@H]([C@H](N2CC3=COC=N3)CO)C4=CC=CC=C4N1C(=O)C5=CC(=CC=C5)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-(4-oxazolylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(3-fluorophenyl)methanone (CHEBI:127481) is a aminoquinoline (CHEBI:36709)
Manual Xref Database
LSM-39039 LINCS
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