CHEBI:126600 - (3aS,4R,9bR)-4-(hydroxymethyl)-N-(2-methoxyphenyl)-8-(4-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide

ChEBI IDCHEBI:126600
ChEBI Name(3aS,4R,9bR)-4-(hydroxymethyl)-N-(2-methoxyphenyl)-8-(4-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide
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FormulaC28H31N3O4
Net Charge0
Average Mass473.573
Monoisotopic Mass473.23146
SMILESCOc1ccc(-c2ccc3c(c2)[C@H]2[C@H](CCN2C(=O)Nc2ccccc2OC)[C@H](CO)N3C)cc1
InChIInChI=1S/C28H31N3O4/c1-30-24-13-10-19(18-8-11-20(34-2)12-9-18)16-22(24)27-21(25(30)17-32)14-15-31(27)28(33)29-23-6-4-5-7-26(23)35-3/h4-13,16,21,25,27,32H,14-15,17H2,1-3H3,(H,29,33)/t21-,25+,27-/m1/s1
InChIKeyQRXKWOGYJQUWPZ-NKPLSRDGSA-N
ChEBI Ontology
Outgoing Relation(s)
(3aS,4R,9bR)-4-(hydroxymethyl)-N-(2-methoxyphenyl)-8-(4-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinoline-1-carboxamide (CHEBI:126600) is a quinolines (CHEBI:26513)
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