CHEBI:227982 - Pestalotether F

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Pestalotether F
ChEBI ID CHEBI:227982
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H20O8
Net Charge 0
Average Mass 376.361
Monoisotopic Mass 376.11582
InChI InChI=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
InChIKey YYRFOGSWKIPVFP-UHFFFAOYSA-N
SMILES O=C(OCC)C1=C(OC2=C(O)C(C(=O)OC)=CC(=C2)OC)C=C(C)C=C1O
Metabolite of Species Details
Pestalotiopsisspecies (NCBI:txid36460) See: DOI
ChEBI Ontology
Outgoing Pestalotether F (CHEBI:227982) is a aromatic ether (CHEBI:35618)
IUPAC Name
ethyl 2-hydroxy-6-(2-hydroxy-5-methoxy-3-methoxycarbonylphenoxy)-4-methylbenzoate