Gyrocyanin (CHEBI:174127)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

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	Gyrocyanin

ChEBI ID	CHEBI:174127

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H12O5

Net Charge

Average Mass

296.278

Monoisotopic Mass

296.06847

InChI

InChI=1S/C17H12O5/c18-11-5-1-9(2-6-11)13-15(20)14(17(22)16(13)21)10-3-7-12(19)8-4-10/h1-8,13,18-19,22H

InChIKey

DIFAFZFNMSLGGN-UHFFFAOYSA-N

SMILES

OC1=C(C(=O)C(C2=CC=C(O)C=C2)C1=O)C3=CC=C(O)C=C3

ChEBI Ontology
Outgoing	Gyrocyanin (CHEBI:174127) is a phenols (CHEBI:33853)

IUPAC Name

4-hydroxy-2,5-bis(4-hydroxyphenyl)cyclopent-4-ene-1,3-dione