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CHEBI:206206 - Herbarin B

ChEBI IDCHEBI:206206
ChEBI NameHerbarin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O5
Net Charge0
Average Mass210.185
Monoisotopic Mass210.05282
SMILESCOc1cc(=O)oc(/C=C/C(=O)O)c1C
InChIInChI=1S/C10H10O5/c1-6-7(3-4-9(11)12)15-10(13)5-8(6)14-2/h3-5H,1-2H3,(H,11,12)/b4-3+
InChIKeyRKIATQDHYLUPSL-ONEGZZNKSA-N
Species of MetaboliteComponentSourceComments
Cladosporium herbarum (ncbitaxon:29918) - DOI (10.1021/np010390i)
ChEBI Ontology
Outgoing Relation(s)
Herbarin B (CHEBI:206206) is a pyranone (CHEBI:37963)
IUPAC Name 
(E)-3-(4-methoxy-3-methyl-6-oxopyran-2-yl)prop-2-enoic acid
Manual XrefsDatabases
9217185ChemSpider