Aspergillusether D (CHEBI:211063)

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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	Aspergillusether D

ChEBI ID	CHEBI:211063

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

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Formula

C20H20Cl2O6

Net Charge

Average Mass

427.270

Monoisotopic Mass

426.06369

InChI

InChI=1S/C20H20Cl2O6/c1-6-8(2)13-16(22)17(24)10(4)18(25)19(13)28-12-7-11(23)15(21)9(3)14(12)20(26)27-5/h6-7,23-25H,1-5H3/b8-6+

InChIKey

JYBXDWXPXSTXCT-SOFGYWHQSA-N

SMILES

ClC1=C(O)C(=C(O)C(=C1/C(=C/C)/C)OC2=C(C(=C(Cl)C(=C2)O)C)C(=O)OC)C

Metabolite of Species	Details
Aspergillus (NCBI:txid5052)	See: DOI

ChEBI Ontology
Outgoing	Aspergillusether D (CHEBI:211063) is a aromatic ether (CHEBI:35618)

IUPAC Name

methyl 6-[2-[(E)-but-2-en-2-yl]-3-chloro-4,6-dihydroxy-5-methylphenoxy]-3-chloro-4-hydroxy-2-methylbenzoate