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CHEBI:219021 - Cyclopaldic acid

ChEBI IDCHEBI:219021
ChEBI NameCyclopaldic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O6
Net Charge0
Average Mass238.195
Monoisotopic Mass238.04774
SMILESCOc1c(C)c(O)c(C=O)c2c1C(=O)O[C@@H]2O
InChIInChI=1S/C11H10O6/c1-4-8(13)5(3-12)6-7(9(4)16-2)11(15)17-10(6)14/h3,10,13-14H,1-2H3/t10-/m0/s1
InChIKeyBHVGIMSTMICYNZ-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Seiridium cupressi (ncbitaxon:138065) - PubMed (23847068)
ChEBI Ontology
Outgoing Relation(s)
Cyclopaldic acid (CHEBI:219021) is a benzofurans (CHEBI:35259)
IUPAC Name 
3,5-dihydroxy-7-methoxy-6-methyl-1-oxo-3H-2-benzouran-4-carbaldehyde
Manual XrefsDatabases
106640ChemSpider