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CHEBI:170019 - N6-[(5-nitro-2-thienyl)methylidene]-2,3-dihydro-1,4-benzodioxin-6-amine

ChEBI IDCHEBI:170019
ChEBI NameN6-[(5-nitro-2-thienyl)methylidene]-2,3-dihydro-1,4-benzodioxin-6-amine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H10N2O4S
Net Charge0
Average Mass290.300
Monoisotopic Mass290.03613
SMILESO=[N+]([O-])c1ccc(/C=N/c2ccc3c(c2)OCCO3)s1
InChIInChI=1S/C13H10N2O4S/c16-15(17)13-4-2-10(20-13)8-14-9-1-3-11-12(7-9)19-6-5-18-11/h1-4,7-8H,5-6H2/b14-8+
InChIKeyXKHKGFIQEGZYJP-RIYZIHGNSA-N
Species of MetaboliteComponentSourceComments
Staphylococcus aureus (ncbitaxon:1280)
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105) Strain: Staphylococcus aureus subsp. aureus USA300 [NCBI:txid367830]
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
Pseudomonas aeruginosa (ncbitaxon:287)
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105) Strain: Pseudomonas aeruginosa UCBPP-PA14 [NCBI:txid208963]
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
unidentified (ncbitaxon:32644) Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
Pseudomonas aeruginosa/Staphylococcus aureus (ncbitaxon:1280) Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
ChEBI Ontology
Outgoing Relation(s)
N6-[(5-nitro-2-thienyl)methylidene]-2,3-dihydro-1,4-benzodioxin-6-amine (CHEBI:170019) is a benzodioxine (CHEBI:64096)
IUPAC Name 
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(5-nitrothiophen-2-yl)methanimine
Manual XrefsDatabases
26461837ChemSpider