Effphenol A (CHEBI:217732)

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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	Effphenol A

ChEBI ID	CHEBI:217732

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C26H26O7

Net Charge

Average Mass

450.487

Monoisotopic Mass

450.16785

InChI

InChI=1S/C26H26O7/c1-5-15-17(28)11-19(31-3)21(24(15)30)23-22-20(32-4)12-18(29)16(6-2)26(22)33-25(23)13-7-9-14(27)10-8-13/h7-12,27-30H,5-6H2,1-4H3

InChIKey

FBFSVNGQQOTBHR-UHFFFAOYSA-N

SMILES

O1C(C2=CC=C(O)C=C2)=C(C3=C(O)C(=C(O)C=C3OC)CC)C=4C1=C(C(O)=CC4OC)CC

Metabolite of Species	Details
Trichobotrys (NCBI:txid1520156)	See: PubMed

ChEBI Ontology
Outgoing	Effphenol A (CHEBI:217732) is a benzofurans (CHEBI:35259)

IUPAC Name

2-ethyl-4-[7-ethyl-6-hydroxy-2-(4-hydroxyphenyl)-4-methoxy-1-benzouran-3-yl]-5-methoxybenzene-1,3-diol