CHEBI:217299 - RES-1214-2

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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-1214-2
ChEBI ID CHEBI:217299
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H15ClO8
Net Charge 0
Average Mass 382.750
Monoisotopic Mass 382.04555
InChI InChI=1S/C17H15ClO8/c1-7-4-9(19)12(16(21)22)10(5-7)26-15-8(17(23)25-3)6-11(24-2)13(18)14(15)20/h4-6,19-20H,1-3H3,(H,21,22)
InChIKey CAXGJVQIPWBEJY-UHFFFAOYSA-N
SMILES ClC1=C(O)C(OC2=C(C(O)=CC(=C2)C)C(=O)O)=C(C(=O)OC)C=C1OC
Metabolite of Species Details
Pestalotiopsis (NCBI:txid37840) See: PubMed
ChEBI Ontology
Outgoing RES-1214-2 (CHEBI:217299) is a aromatic ether (CHEBI:35618)
IUPAC Name
2-(3-chloro-2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-6-hydroxy-4-methylbenzoic acid
Manual Xref Database
8018695 ChemSpider
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