Rubetauphelin A (CHEBI:218500)

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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	Rubetauphelin A

ChEBI ID	CHEBI:218500

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H14Cl4O6

Net Charge

Average Mass

492.130

Monoisotopic Mass

489.95445

InChI

InChI=1S/C20H14Cl4O6/c1-27-11-7-16(29-18-12(21)3-9(25)4-13(18)22)20(28-2)17(8-11)30-19-14(23)5-10(26)6-15(19)24/h3-8,25-26H,1-2H3

InChIKey

DXTLLBQWXWSRKJ-UHFFFAOYSA-N

SMILES

ClC1=C(OC2=C(OC)C(OC3=C(Cl)C=C(O)C=C3Cl)=CC(=C2)OC)C(Cl)=CC(=C1)O

Metabolite of Species	Details
Russula subnigricans (NCBI:txid258989)	See: PubMed

ChEBI Ontology
Outgoing	Rubetauphelin A (CHEBI:218500) is a aromatic ether (CHEBI:35618)

IUPAC Name

3,5-dichloro-4-[3-(2,6-dichloro-4-hydroxyphenoxy)-2,5-dimethoxyphenoxy]phenol