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CHEBI:91636 - 4-[3-(3-dioxaziridinyl)phenyl]-5-(3-hydroxy-1-oxopropyl)-2,6-dimethyl-1-prop-2-ynyl-4H-pyridine-3-carboxylic acid methyl ester

ChEBI IDCHEBI:91636
ChEBI Name4-[3-(3-dioxaziridinyl)phenyl]-5-(3-hydroxy-1-oxopropyl)-2,6-dimethyl-1-prop-2-ynyl-4H-pyridine-3-carboxylic acid methyl ester
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FormulaC21H22N2O6
Net Charge0
Average Mass398.415
Monoisotopic Mass398.14779
SMILESC#CCN1C(C)=C(C(=O)CCO)C(c2cccc(-n3oo3)c2)C(C(=O)OC)=C1C
InChIInChI=1S/C21H22N2O6/c1-5-10-22-13(2)18(17(25)9-11-24)20(19(14(22)3)21(26)27-4)15-7-6-8-16(12-15)23-28-29-23/h1,6-8,12,20,24H,9-11H2,2-4H3
InChIKeyVNIMHBLANIQWNY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[3-(3-dioxaziridinyl)phenyl]-5-(3-hydroxy-1-oxopropyl)-2,6-dimethyl-1-prop-2-ynyl-4H-pyridine-3-carboxylic acid methyl ester (CHEBI:91636) is a dihydropyridine (CHEBI:50075)
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