CHEBI:129351 - [(3aR,4R,9bS)-4-(hydroxymethyl)-8-(3-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-(1,3-benzodioxol-5-yl)methanone

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ChEBI Name [(3aR,4R,9bS)-4-(hydroxymethyl)-8-(3-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-(1,3-benzodioxol-5-yl)methanone ChEBI ID CHEBI:129351 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C28H28N2O5 Net Charge 0 Average Mass 472.533 Monoisotopic Mass 472.19982 InChI InChI=1S/C28H28N2O5/c1-29-23-8-6-18(17-4-3-5-20(12-17)33-2)13-22(23)27-21(24(29)15-31)10-11-30(27)28(32)19-7-9-25-26(14-19)35-16-34-25/h3-9,12-14,21,24,27,31H,10-11,15-16H2,1-2H3/t21-,24-,27-/m0/s1 InChIKey ZSJKMADIWCANIW-DDZLNHKNSA-N SMILES CN1[C@H]([C@@H]2CCN([C@@H]2C3=C1C=CC(=C3)C4=CC(=CC=C4)OC)C(=O)C5=CC6=C(C=C5)OCO6)CO ChEBI Ontology Outgoing [(3aR,4R,9bS)-4-(hydroxymethyl)-8-(3-methoxyphenyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-(1,3-benzodioxol-5-yl)methanone (CHEBI:129351) is a quinolines (CHEBI:26513) Manual Xref Database LSM-40902 LINCS View more database links