8,8'-dicarboxy-1,1'-binaphthalene (CHEBI:228723)

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CHEBI:228723 - 8,8'-dicarboxy-1,1'-binaphthalene

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ChEBI ID	CHEBI:228723
ChEBI Name	8,8'-dicarboxy-1,1'-binaphthalene
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C22H14O4
Net Charge	0
Average Mass	342.350
Monoisotopic Mass	342.08921
SMILES	O=C(O)c1cccc2cccc(-c3cccc4cccc(C(=O)O)c34)c12
InChI	InChI=1S/C22H14O4/c23-21(24)17-11-3-7-13-5-1-9-15(19(13)17)16-10-2-6-14-8-4-12-18(20(14)16)22(25)26/h1-12H,(H,23,24)(H,25,26)
InChIKey	XGDAODQNSVFBGM-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	urine (BTO:0001419)	MetaboLights (MTBLS8662)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	8,8'-dicarboxy-1,1'-binaphthalene (CHEBI:228723) is a naphthoic acid (CHEBI:25483)

IUPAC Name
8-(8-carboxynaphthalen-1-yl)naphthalene-1-carboxylic acid

Manual Xrefs	Databases
85633	ChemSpider