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CHEBI:215188 - Leptothiazinone A

ChEBI IDCHEBI:215188
ChEBI NameLeptothiazinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H11NO3S
Net Charge0
Average Mass225.269
Monoisotopic Mass225.04596
SMILESO=C1CSc2cc(CCO)cc(O)c2N1
InChIInChI=1S/C10H11NO3S/c12-2-1-6-3-7(13)10-8(4-6)15-5-9(14)11-10/h3-4,12-13H,1-2,5H2,(H,11,14)
InChIKeyIWEKZEVSQBHYNG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Leptosphaerulina (ncbitaxon:55172) - DOI (10.1016/j.phytol.2018.06.016)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
Leptothiazinone A (CHEBI:215188) is a benzothiazine (CHEBI:46899)
IUPAC Name 
5-hydroxy-7-(2-hydroxyethyl)-4H-1,4-benzothiazin-3-one
Manual XrefsDatabases
71048614ChemSpider