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CHEBI:220098 - Phomonitroester

ChEBI IDCHEBI:220098
ChEBI NamePhomonitroester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H13NO5
Net Charge0
Average Mass239.227
Monoisotopic Mass239.07937
SMILESO=C(CC[N+](=O)[O-])OCCc1ccc(O)cc1
InChIInChI=1S/C11H13NO5/c13-10-3-1-9(2-4-10)6-8-17-11(14)5-7-12(15)16/h1-4,13H,5-8H2
InChIKeyRFTGOLDMAQHAKU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - PubMed (17950385)
ChEBI Ontology
Outgoing Relation(s)
Phomonitroester (CHEBI:220098) is a alcohol (CHEBI:30879)
Phomonitroester (CHEBI:220098) is a phenols (CHEBI:33853)
IUPAC Name 
2-(4-hydroxyphenyl)ethyl 3-nitropropanoate
Manual XrefsDatabases
58828678ChemSpider