1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(3-pyridinyl)ethanone (CHEBI:128698)

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CHEBI:128698 - 1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(3-pyridinyl)ethanone

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ChEBI ID	CHEBI:128698
ChEBI Name	1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(3-pyridinyl)ethanone
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Formula	C26H25N3O4
Net Charge	0
Average Mass	443.503
Monoisotopic Mass	443.18451
SMILES	COc1ccccc1C(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2C(=O)Cc1cccnc1
InChI	InChI=1S/C26H25N3O4/c1-33-23-11-5-3-9-19(23)26(32)28-15-21-25(18-8-2-4-10-20(18)28)22(16-30)29(21)24(31)13-17-7-6-12-27-14-17/h2-12,14,21-22,25,30H,13,15-16H2,1H3/t21-,22+,25+/m1/s1
InChIKey	XLJJZSBNOHLXNG-SLSDLSHTSA-N

ChEBI Ontology

Outgoing Relation(s)
	1-[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(2-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-2-(3-pyridinyl)ethanone (CHEBI:128698) is a quinolines (CHEBI:26513)

Manual Xrefs	Databases
LSM-40252	LINCS