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CHEBI:227736 - Acrodontiolamide

ChEBI IDCHEBI:227736
ChEBI NameAcrodontiolamide
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SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12Cl2N2O5
Net Charge0
Average Mass323.132
Monoisotopic Mass322.01233
SMILESNC(=O)C(COC(Cl)Cl)C(O)c1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C11H12Cl2N2O5/c12-11(13)20-5-8(10(14)17)9(16)6-1-3-7(4-2-6)15(18)19/h1-4,8-9,11,16H,5H2,(H2,14,17)
InChIKeyFHDPTOGOPLCNDA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Acrodontium salmoneum (ncbitaxon:2074753) - DOI (10.1080/00387019308011616)
ChEBI Ontology
Outgoing Relation(s)
Acrodontiolamide (CHEBI:227736) is a C-nitro compound (CHEBI:35716)
IUPAC Name 
2-(dichloromethoxymethyl)-3-hydroxy-3-(4-nitrophenyl)propanamide
Manual XrefsDatabases
154891ChemSpider