2-{[hydroxy(6-hydroxy-2H-1,3-benzodioxol-5-yl)methylidene]amino}acetic acid (CHEBI:180790)

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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	2-{[hydroxy(6-hydroxy-2H-1,3-benzodioxol-5-yl)methylidene]amino}acetic acid

ChEBI ID	CHEBI:180790

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H9NO6

Net Charge

Average Mass

239.183

Monoisotopic Mass

239.04299

InChI

InChI=1S/C10H9NO6/c12-6-2-8-7(16-4-17-8)1-5(6)10(15)11-3-9(13)14/h1-2,12H,3-4H2,(H,11,15)(H,13,14)

InChIKey

BSGZBTVJZSNKKJ-UHFFFAOYSA-N

SMILES

O1C2=C(OC1)C=C(O)C(=C2)C(=O)NCC(O)=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood serum (BTO:0000133).

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	2-{[hydroxy(6-hydroxy-2H-1,3-benzodioxol-5-yl)methylidene]amino}acetic acid (CHEBI:180790) is a N-acyl-amino acid (CHEBI:51569)

IUPAC Name

2-[(6-hydroxy-1,3-benzodioxole-5-carbonyl)amino]acetic acid