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CHEBI:211050 - Aspergillusether B

Default Structure
ChEBI IDCHEBI:211050
ChEBI NameAspergillusether B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILESC/C=C(\C)c1cc(O)c(C)c(O)c1Oc1cc(O)cc(C)c1C(=O)OC
InChIInChI=1S/C20H22O6/c1-6-10(2)14-9-15(22)12(4)18(23)19(14)26-16-8-13(21)7-11(3)17(16)20(24)25-5/h6-9,21-23H,1-5H3/b10-6+
InChIKeyMRFZDDXTMDVMTM-UXBLZVDNSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - DOI (10.1016/j.tet.2017.08.039)
ChEBI Ontology
Outgoing Relation(s)
Aspergillusether B (CHEBI:211050) is a aromatic ether (CHEBI:35618)
IUPAC Name 
methyl 2-[6-[(E)-but-2-en-2-yl]-2,4-dihydroxy-3-methylphenoxy]-4-hydroxy-6-methylbenzoate
Manual XrefsDatabases
78435257ChemSpider