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3-Hydroxyanthranilic acid
SpectraBase Compound ID 3Qurqhc3KFR
InChI InChI=1S/C7H7NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3,9H,8H2,(H,10,11)
InChIKey WJXSWCUQABXPFS-UHFFFAOYSA-N
Mol Weight 153.14 g/mol
Molecular Formula C7H7NO3
Exact Mass 153.042593 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HMAnG1kowxr
Name 3-Hydroxyanthranilic acid
Acquisition Mode SIMULTANEOUS
CAS Registry Number 548-93-6
ChEBI ID 15793
Comments 100 mM 3-Hydroxyanthranilic acid - Sigma-Aldrich H9391 Solvent D2O Buffer sodium phosphate Cytocide sodium azide Reference DSS; pH 7.4, temperature 298 K
Copyright Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Source Madison Metabolomics Consortium
Formula C7 H7 N O3
IUPAC Name 2-amino-3-hydroxybenzoic acid; 2-amino-3-hydroxy-benzoic acid
InChI InChI=1S/C7H7NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3,9H,8H2,(H,10,11)
InChIKey WJXSWCUQABXPFS-UHFFFAOYSA-N
KEGG Compound ID C00632
KEGG Pathways PATH: ko00380 Tryptophan metabolism PATH: ko00629 Carbazole degradation
PubChem Compound ID 86
SMILES C1=CC(=C(C(=C1)O)N)C(=O)O
Source File Reference bmse000321