CHEBI:121251 - 5-hydroxy-2-methyl-4-[1-piperidinyl(3-pyridinyl)methyl]-3-benzo[g]benzofurancarboxylic acid ethyl ester

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ChEBI Name 5-hydroxy-2-methyl-4-[1-piperidinyl(3-pyridinyl)methyl]-3-benzo[g]benzofurancarboxylic acid ethyl ester
ChEBI ID CHEBI:121251
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H28N2O4
Net Charge 0
Average Mass 444.523
Monoisotopic Mass 444.20491
InChI InChI=1S/C27H28N2O4/c1-3-32-27(31)21-17(2)33-26-20-12-6-5-11-19(20)25(30)23(22(21)26)24(18-10-9-13-28-16-18)29-14-7-4-8-15-29/h5-6,9-13,16,24,30H,3-4,7-8,14-15H2,1-2H3
InChIKey IAQKXFGPYLIQMT-UHFFFAOYSA-N
SMILES CCOC(=O)C1=C(OC2=C1C(=C(C3=CC=CC=C32)O)C(C4=CN=CC=C4)N5CCCCC5)C
ChEBI Ontology
Outgoing 5-hydroxy-2-methyl-4-[1-piperidinyl(3-pyridinyl)methyl]-3-benzo[g]benzofurancarboxylic acid ethyl ester (CHEBI:121251) is a naphthofuran (CHEBI:39270)
Manual Xref Database
LSM-32694 LINCS
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