2-Hydroxyhippuric acid

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Systematic / IUPAC Name: N-(2-Hydroxybenzoyl)glycine

ID: Reference529

Other Names: N-Salicyloylglycine;
Glycine, N-salicyloyl-;
Salicylglycine;
Salicylurate;
Salicyluric acid ; more

Formula: C9H9NO4

Class: Endogenous Metabolites

Spectral Data

2-Hydroxyhippuric acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite; Q Exactive Orbitrap
No. of Spectral Trees 7
No. of Spectra 1207
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI; APCI; NSI
Analyzers FT
Last Modification 10/11/2016 1:30:32 PM
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Identificators

InChI InChI=1S/C9H9NO4/c11-7-4-2-1-3-6(7)9(14)10-5-8(12)13/h1-4,11H,5H2,(H,10,14)(H,12,13)
InChI Key ONJSZLXSECQROL-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C(=C1)C(=O)NCC(=O)O)O
CAS 487547
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Other Names N-Salicyloylglycine;
Glycine, N-salicyloyl-;
Salicylglycine;
Salicylurate;
Salicyluric acid;
[(2-Hydroxybenzoyl)amino]acetic acid ;
(2-Hydroxybenzamido)acetic acid;
(2-Hydroxybenzoyl)glycine;
[(2-Hydroxybenzoyl)amino]acetic acid;
N-o-Hydroxybenzoylglycine;
o-Hydroxyhippuric acid;
2-(2-Hydroxybenzamido)acetic acid;
2-[(2-Hydroxyphenyl)carbonylamino]acetic acid;
2-[(2-Hydroxyphenyl)formamido]acetic acid;
2-[(Carboxymethyl)carbamoyl]phenol;
2-Hydroxybenzoylglycine;
Glycine, N-(2-hydroxybenzoyl)-;
Hippuric acid, o-hydroxy-;
Hippuric acid, 2-hydroxy-

In Other Databases

KEGG C07588
Wikipedia Salicyluric acid
HMDb HMDB00840
ChEBI CHEBI:9008
PubChem 10253
ChEMBL CHEMBL586
ChemSpider 9835
ChemIDPlus 000487547