CHEBI:168794 - 2-{[hydroxy(2,3,4,5-tetrahydroxyphenyl)methylidene]amino}acetic acid

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ChEBI Name 2-{[hydroxy(2,3,4,5-tetrahydroxyphenyl)methylidene]amino}acetic acid
ChEBI ID CHEBI:168794
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H9NO7
Net Charge 0
Average Mass 243.171
Monoisotopic Mass 243.03790
InChI InChI=1S/C9H9NO7/c11-4-1-3(6(14)8(16)7(4)15)9(17)10-2-5(12)13/h1,11,14-16H,2H2,(H,10,17)(H,12,13)
InChIKey CEGXMLMKPLWUDD-UHFFFAOYSA-N
SMILES OC=1C(=CC(O)=C(O)C1O)C(=O)NCC(O)=O
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via ubiquinol )
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via ubiquinol )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-{[hydroxy(2,3,4,5-tetrahydroxyphenyl)methylidene]amino}acetic acid (CHEBI:168794) is a ubiquinol (CHEBI:17976)
IUPAC Name
2-[(2,3,4,5-tetrahydroxybenzoyl)amino]acetic acid
Manual Xrefs Databases
74851961 ChemSpider
HMDB0126648 HMDB
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