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Biological Magnetic Resonance Data BankA Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules |
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Anthranilic Acid
Anthranilic_acid synonyms
o-Aminobenzoic acid; 2-Carboxyaniline; Anthranilic acid; Benzoic acid, o-amino-; Kyselina o-aminobenzoova [Czech]; Anthranilate; o-Carboxyaniline; ortho-Aminobenzoic acid; 2-Aminobenzoic acid; ANTHRANILIC ACID; Benzoic acid, 2-amino-
Graphical representations:
View large 3D structure
Molecular Formula: C7H7NO2
Natural Isotopic Abundance Mass: 137.1359800000
Mono-Isotopic Molecular Masses:
- C12N14: 137.047678474
- C13N14: 144.071162339
- C12N15: 138.044713367
- C13N15: 144.071162339
InChI string: InChI=1/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10)/f/h9H
IUPAC: 2-aminobenzoic acid
PubChem Compound (CID): 227KEGG Compound ID: C00108
CAS Registry number: 118-92-3 14342-65-5 2099-63-0 552-37-4 60613-06-1 7058-55-1 7459-95-2 80206-34-4
ChEBI: 30754
CCRIS: 49
HSDB: 1321
EINECS: 204-287-5
NSC: 144
Beilstein Handbook Reference: 4-27-00-07875
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)