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CHEBI:107738 - 6-amino-5-cyano-4-(2,4-dimethoxyphenyl)-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid ethyl ester

ChEBI IDCHEBI:107738
ChEBI Name6-amino-5-cyano-4-(2,4-dimethoxyphenyl)-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid ethyl ester
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DownloadsMolfile
FormulaC21H24N2O7
Net Charge0
Average Mass416.430
Monoisotopic Mass416.15835
SMILESCCOC(=O)CC1=C(C(=O)OCC)C(c2ccc(OC)cc2OC)C(C#N)=C(N)O1
InChIInChI=1S/C21H24N2O7/c1-5-28-17(24)10-16-19(21(25)29-6-2)18(14(11-22)20(23)30-16)13-8-7-12(26-3)9-15(13)27-4/h7-9,18H,5-6,10,23H2,1-4H3
InChIKeyWDTJEMBCCFOELH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-amino-5-cyano-4-(2,4-dimethoxyphenyl)-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid ethyl ester (CHEBI:107738) is a dimethoxybenzene (CHEBI:51681)
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