CHEBI:198514 - RES-1214-1

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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 RES-1214-1
ChEBI ID CHEBI:198514
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H16O8
Net Charge 0
Average Mass 348.307
Monoisotopic Mass 348.08452
InChI InChI=1S/C17H16O8/c1-8-4-11(18)14(16(20)21)13(5-8)25-15-10(17(22)24-3)6-9(23-2)7-12(15)19/h4-7,18-19H,1-3H3,(H,20,21)
InChIKey SOXXAFVUSIMAGB-UHFFFAOYSA-N
SMILES O=C(OC)C1=C(OC2=C(C(O)=CC(=C2)C)C(=O)O)C(O)=CC(=C1)OC
Metabolite of Species Details
Pestalotiopsis (NCBI:txid37840) See: PubMed
ChEBI Ontology
Outgoing RES-1214-1 (CHEBI:198514) is a aromatic ether (CHEBI:35618)
IUPAC Name
2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoic acid
Manual Xref Database
8072387 ChemSpider
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