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

ChEBI IDCHEBI:127481
ChEBI Name[(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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DownloadsMolfile
FormulaC22H20FN3O3
Net Charge0
Average Mass393.418
Monoisotopic Mass393.14887
SMILESO=C(c1cccc(F)c1)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2Cc1cocn1
InChIInChI=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
InChIKeyLADYXEYYHNMFGT-PWRODBHTSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
[(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)
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