CHEBI:104923 - 1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethanone
ChEBI ID CHEBI:104923
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H19N3O4
Net Charge 0
Average Mass 329.351
Monoisotopic Mass 329.13756
InChI InChI=1S/C17H19N3O4/c1-5-8-19-12(3)9-14(13(19)4)15(21)10-24-16-7-6-11(2)18-17(16)20(22)23/h5-7,9H,1,8,10H2,2-4H3
InChIKey UIQMPVFCYITWMX-UHFFFAOYSA-N
SMILES CC1=NC(=C(C=C1)OCC(=O)C2=C(N(C(=C2)C)CC=C)C)[N+](=O)[O-]
ChEBI Ontology
Outgoing 1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethanone (CHEBI:104923) is a C-nitro compound (CHEBI:35716)
Manual Xref Database
LSM-16286 LINCS
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