CHEBI:105579 - 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propyl ester
ChEBI ID CHEBI:105579
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H19N3O7
Net Charge 0
Average Mass 377.349
Monoisotopic Mass 377.12230
InChI InChI=1S/C17H19N3O7/c1-4-5-25-16(21)14-9(2)19(3)17(22)18-15(14)10-6-12-13(27-8-26-12)7-11(10)20(23)24/h6-7,15H,4-5,8H2,1-3H3,(H,18,22)
InChIKey OQWOCRDDBQMUER-UHFFFAOYSA-N
SMILES CCCOC(=O)C1=C(N(C(=O)NC1C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C)C
ChEBI Ontology
Outgoing 3,4-dimethyl-6-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propyl ester (CHEBI:105579) is a benzodioxoles (CHEBI:38298)
Manual Xref Database
LSM-16942 LINCS
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