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CHEBI:223839 - (4-Hydroxy-3,5-dinitrophenyl)-propionic acid methyl ester

ChEBI IDCHEBI:223839
ChEBI Name(4-Hydroxy-3,5-dinitrophenyl)-propionic acid methyl ester
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SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10N2O7
Net Charge0
Average Mass270.197
Monoisotopic Mass270.04880
SMILESCOC(=O)CCc1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1
InChIInChI=1S/C10H10N2O7/c1-19-9(13)3-2-6-4-7(11(15)16)10(14)8(5-6)12(17)18/h4-5,14H,2-3H2,1H3
InChIKeyDQLWOAONCUINLZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Salegentibacterspecies T436 (ncbitaxon:1729720) - PubMed (17551208)
ChEBI Ontology
Outgoing Relation(s)
(4-Hydroxy-3,5-dinitrophenyl)-propionic acid methyl ester (CHEBI:223839) is a dinitrophenol (CHEBI:39352)
IUPAC Name 
methyl 3-(4-hydroxy-3,5-dinitrophenyl)propanoate
Manual XrefsDatabases
3764403ChemSpider