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CHEBI:201513 - Corynecin

ChEBI IDCHEBI:201513
ChEBI NameCorynecin
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FormulaC13H16N2O6
Net Charge0
Average Mass296.279
Monoisotopic Mass296.10084
SMILESCC(=O)NC(COC(C)=O)C(O)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C13H16N2O6/c1-8(16)14-12(7-21-9(2)17)13(18)10-3-5-11(6-4-10)15(19)20/h3-6,12-13,18H,7H2,1-2H3,(H,14,16)
InChIKeyBDRQNWQWGITGRM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Corynecin (CHEBI:201513) is a C-nitro compound (CHEBI:35716)
IUPAC Name 
[(2R,3R)-2-acetamido-3-hydroxy-3-(4-nitrophenyl)propyl] acetate
Manual XrefsDatabases
71117186ChemSpider