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CHEBI:211703 - Islandic acid-II

ChEBI IDCHEBI:211703
ChEBI NameIslandic acid-II
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12O7
Net Charge0
Average Mass256.210
Monoisotopic Mass256.05830
SMILESCOc1c(CO)c(/C=C/C(=O)O)oc(=O)c1CO
InChIInChI=1S/C11H12O7/c1-17-10-6(4-12)8(2-3-9(14)15)18-11(16)7(10)5-13/h2-3,12-13H,4-5H2,1H3,(H,14,15)/b3-2+
InChIKeyJKXCQNJJGAVAGA-NSCUHMNNSA-N
Species of MetaboliteComponentSourceComments
Talaromyces islandicus (ncbitaxon:28573) - PubMed (6547880)
ChEBI Ontology
Outgoing Relation(s)
Islandic acid-II (CHEBI:211703) is a pyranone (CHEBI:37963)
IUPAC Name 
(E)-3-[3,5-bis(hydroxymethyl)-4-methoxy-6-oxopyran-2-yl]prop-2-enoic acid
Manual XrefsDatabases
62929002ChemSpider