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CHEBI:227982 - Pestalotether F

ChEBI IDCHEBI:227982
ChEBI NamePestalotether F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O8
Net Charge0
Average Mass376.361
Monoisotopic Mass376.11582
SMILESCCOC(=O)c1c(O)cc(C)cc1Oc1cc(OC)cc(C(=O)OC)c1O
InChIInChI=1S/C19H20O8/c1-5-26-19(23)16-13(20)6-10(2)7-14(16)27-15-9-11(24-3)8-12(17(15)21)18(22)25-4/h6-9,20-21H,5H2,1-4H3
InChIKeyYYRFOGSWKIPVFP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsisspecies (ncbitaxon:36460) - DOI (10.1016/j.phytol.2018.11.021)
ChEBI Ontology
Outgoing Relation(s)
Pestalotether F (CHEBI:227982) is a aromatic ether (CHEBI:35618)
IUPAC Name 
ethyl 2-hydroxy-6-(2-hydroxy-5-methoxy-3-methoxycarbonylphenoxy)-4-methylbenzoate