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CHEBI:128402 - 1-[(1S,2aR,8bR)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone

ChEBI IDCHEBI:128402
ChEBI Name1-[(1S,2aR,8bR)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone
Stars
DownloadsMolfile
FormulaC21H24N2O3
Net Charge0
Average Mass352.434
Monoisotopic Mass352.17869
SMILESCOCC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2Cc1ccccc1
InChIInChI=1S/C21H24N2O3/c1-26-14-20(25)23-12-18-21(16-9-5-6-10-17(16)23)19(13-24)22(18)11-15-7-3-2-4-8-15/h2-10,18-19,21,24H,11-14H2,1H3/t18-,19+,21+/m0/s1
InChIKeyMGHMIPQLSFYHQM-QKNQBKEWSA-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)
1-[(1S,2aR,8bR)-1-(hydroxymethyl)-2-(phenylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-2-methoxyethanone (CHEBI:128402) is a aminoquinoline (CHEBI:36709)
Manual XrefsDatabases
LSM-39957LINCS