herqueinone(1-) (CHEBI:145876)

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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	herqueinone(1−)

ChEBI ID	CHEBI:145876

ChEBI ASCII Name	herqueinone(1-)

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

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C20H19O7

Net Charge

-1

Average Mass

371.366

Monoisotopic Mass

371.11363

InChI

InChI=1S/C20H20O7/c1-7-6-9(21)11-12-10(7)18-20(25,19(3,4)8(2)27-18)17(24)13(12)15(23)16(26-5)14(11)22/h6,8,22-23,25H,1-5H3/p-1/t8-,20-/m1/s1

InChIKey

PKJJEYCUTMFGJW-ZPWHCFADSA-M

SMILES

C=12C3=C(C([C@]4(C1O[C@@H](C4(C)C)C)O)=O)C(=C(C(=C3C(C=C2C)=O)[O-])OC)O

ChEBI Ontology
Outgoing	herqueinone(1−) (CHEBI:145876) is a dihydrofuran (CHEBI:51659) herqueinone(1−) (CHEBI:145876) is a organic anion (CHEBI:25696)

Synonym	Source
herqueinone	UniProt