1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(4-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(2-pyridinyl)ethanone (CHEBI:126403)

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CHEBI:126403 - 1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(4-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(2-pyridinyl)ethanone

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ChEBI ID	CHEBI:126403
ChEBI Name	1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(4-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(2-pyridinyl)ethanone
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Downloads	Molfile

Formula	C26H25N3O4
Net Charge	0
Average Mass	443.503
Monoisotopic Mass	443.18451
SMILES	COc1ccc(C(=O)N2C[C@@H]3[C@H](c4ccccc42)[C@H](CO)N3C(=O)Cc2ccccn2)cc1
InChI	InChI=1S/C26H25N3O4/c1-33-19-11-9-17(10-12-19)26(32)28-15-22-25(20-7-2-3-8-21(20)28)23(16-30)29(22)24(31)14-18-6-4-5-13-27-18/h2-13,22-23,25,30H,14-16H2,1H3/t22-,23+,25+/m1/s1
InChIKey	DGLFMVGGHBCJKX-CUYJMHBOSA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(4-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(2-pyridinyl)ethanone (CHEBI:126403) is a quinolines (CHEBI:26513)

Manual Xrefs	Databases
LSM-37968	LINCS