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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:benzoic acid
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Accession:CHEBI:30746 term browser browse the term
Definition:A compound comprising a benzene ring core carrying a carboxylic acid substituent.
Synonyms:related_synonym: Aromatic carboxylic acid;   Benzenecarboxylic acid;   Benzeneformic acid;   Benzenemethanoic acid;   Benzoesaeure;   Dracylic acid;   E210;   Formula=C7H6O2;   InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9);   InChIKey=WPYMKLBDIGXBTP-UHFFFAOYSA-N;   Phenylcarboxylic acid;   Phenylformic acid;   SMILES=OC(=O)c1ccccc1;   acide benzoique
 alt_id: CHEBI:22722;   CHEBI:3029;   CHEBI:41051
 xref: CAS:65-85-0;   DrugBank:DB03793;   Drug_Central:4664;   Gmelin:2946;   HMDB:HMDB0001870;   KEGG:C00180;   KEGG:C00539;   KEGG:D00038;   KNApSAcK:C00000207;   LINCS:LSM-37118
 xref_mesh: MESH:D019817
 xref: MetaCyc:BENZOATE;   PDBeChem:BEZ;   PMID:16728954;   PMID:17439666;   PMID:18314336;   PPDB:1475;   Reaxys:636131;   Wikipedia:Benzoic_Acid;   YMDB:YMDB02301
 cyclic_relationship: is_conjugate_acid_of CHEBI:16150

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Path 1
Term Annotations click to browse term
  CHEBI ontology 2
    role 2
      biological role 2
        antimicrobial agent 1
          antimicrobial food preservative 0
            benzoic acid 0
              1-(4-carboxy-2-guanidinophenyl)-5,5-bis(hydroxymethyl)pyrrolidin-2-one 0
              1-[4-carboxy-2-(3-pentylamino)phenyl]-5,5-bis(hydroxymethyl)pyrrolidin-2-one 0
              2,3-dichlorobenzoic acid 0
              2,3-dihydroxybenzoic acid + 0
              2,3-dimethylbenzoic acid 0
              2,4,6-trimethylbenzoic acid 0
              2,4-dichlorobenzoic acid + 0
              2,4-dimethylbenzoic acid 0
              2,5-dihydroxybenzoic acid + 0
              2,5-dimethylbenzoic acid 0
              2,6-dichlorobenzoic acid + 0
              2,6-dimethylbenzoic acid 0
              2-(\{3-[(2S)-2-amino-2-carboxyethyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl\}methyl)benzoic acid 0
              2-(benzoylamino)-4-nitrobenzoic acid 0
              2-[(benzoylamino)methyl]-3,4,6-trichlorophenyl 4-nitrobenzoate 0
              2-chloro-5-(5-\{(E)-[(2Z)-3-(2-methoxyethyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl\}furan-2-yl)benzoic acid 0
              2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid 0
              2-halobenzoic acid + 0
              2-nitrobenzoic acid 0
              2-succinylbenzoic acid + 0
              3,4,5-trimethoxybenzoic acid + 0
              3,4-dihydroxybenzoic acid + 0
              3,4-dimethoxybenzoic acid + 0
              3,4-dimethylbenzoic acid 0
              3,5-dibromo-4-hydroxybenzoic acid 0
              3,5-dichloro-4-hydroxybenzoic acid 0
              3,5-dichlorobenzoic acid 0
              3,5-dihydroxybenzoic acid 0
              3,5-dimethylbenzoic acid 0
              3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid 0
              3-aminobenzoic acid + 0
              3-bromo-4,5-dihydroxybenzoic acid 0
              3-bromo-4-hydroxybenzoic acid 0
              3-chlorobenzoic acid 0
              3-ethoxybenzoic acid 0
              3-hexaprenyl-4,5-dihydroxybenzoic acid 0
              3-hexaprenyl-4-hydroxy-5-methoxybenzoic acid 0
              3-hydroxybenzoic acid + 0
              3-oxalobenzoic acid 0
              4-(2-carboxyphenyl)-2-oxobut-3-enoic acid + 0
              4-(4-\{(2S,5S)-5-[2-(dibenzylamino)-2-oxoethyl]-2-heptyl-4-oxo-1,3-thiazolidin-3-yl\}butyl)benzoic acid 0
              4-(beta-D-glucosyloxy)benzoic acid 0
              4-[(2R)-2-(aminomethyl)-2-(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-[(1-ethylpropyl)amino]benzoic acid 0
              4-[2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-dioxolan-2-yl]benzoic acid 0
              4-\{5-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl\}benzoic acid 0
              4-\{[(2R,5S)-5-\{[(2S)-2-(aminomethyl)pyrrolidin-1-yl]carbonyl\}pyrrolidin-2-yl]methoxy\}-3-tert-butylbenzoic acid 0
              4-aminobenzoic acid + 0
              4-chlorobenzoic acid + 0
              4-hydroxy-3-octaprenylbenzoic acid 0
              4-isothiocyanatobenzoic acid 0
              4-methoxybenzoic acid + 0
              4-nitrobenzoic acid + 0
              4-sulfobenzoic acid 0
              5-chlorosalicylic acid + 0
              5-sulfosalicylic acid 0
              N-benzoyl-D-arginines + 0
              N-benzoyl-L-arginine 0
              N-benzoyl-L-phenylalaninol + 0
              benzamidine 0
              benzohydrazide + 0
              benzoic anhydride + 0
              benzoyl chloride + 0
              benzoyl cyanide 0
              benzoyl group 0
              benzoyl-CoA + 0
              benzoyl-beta-D-glucoside 0
              benzoylacetonitrile 0
              benzoyloxy group 0
              benzyl benzoate 0
              carboxy-PTIO 0
              fluorobenzoic acid + 0
              geranyl benzoate 0
              hexadecyl benzoate 0
              hydroxybenzoic acid + 0
              isobutyl benzoate 0
              macrophomic acid 0
              metronidazole benzoate 0
              octyl benzoate 0
              p-chloromercuribenzoic acid 0
              p-mercuribenzoic acid 0
              pentafluorobenzoic acid + 0
              phenethyl benzoate 0
              tert-butyl benzoate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    p-block element atom 2
                      carbon group element atom 2
                        carbon atom 2
                          organic molecular entity 2
                            heteroorganic entity 2
                              organochalcogen compound 1
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      aromatic carboxylic acid 0
                                        benzoic acids 0
                                          benzoic acid 0
                                            1-(4-carboxy-2-guanidinophenyl)-5,5-bis(hydroxymethyl)pyrrolidin-2-one 0
                                            1-[4-carboxy-2-(3-pentylamino)phenyl]-5,5-bis(hydroxymethyl)pyrrolidin-2-one 0
                                            2,3-dichlorobenzoic acid 0
                                            2,3-dihydroxybenzoic acid + 0
                                            2,3-dimethylbenzoic acid 0
                                            2,4,6-trimethylbenzoic acid 0
                                            2,4-dichlorobenzoic acid + 0
                                            2,4-dimethylbenzoic acid 0
                                            2,5-dihydroxybenzoic acid + 0
                                            2,5-dimethylbenzoic acid 0
                                            2,6-dichlorobenzoic acid + 0
                                            2,6-dimethylbenzoic acid 0
                                            2-(\{3-[(2S)-2-amino-2-carboxyethyl]-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl\}methyl)benzoic acid 0
                                            2-(benzoylamino)-4-nitrobenzoic acid 0
                                            2-[(benzoylamino)methyl]-3,4,6-trichlorophenyl 4-nitrobenzoate 0
                                            2-chloro-5-(5-\{(E)-[(2Z)-3-(2-methoxyethyl)-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl\}furan-2-yl)benzoic acid 0
                                            2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylbenzoic acid 0
                                            2-halobenzoic acid + 0
                                            2-nitrobenzoic acid 0
                                            2-succinylbenzoic acid + 0
                                            3,4,5-trimethoxybenzoic acid + 0
                                            3,4-dihydroxybenzoic acid + 0
                                            3,4-dimethoxybenzoic acid + 0
                                            3,4-dimethylbenzoic acid 0
                                            3,5-dibromo-4-hydroxybenzoic acid 0
                                            3,5-dichloro-4-hydroxybenzoic acid 0
                                            3,5-dichlorobenzoic acid 0
                                            3,5-dihydroxybenzoic acid 0
                                            3,5-dimethylbenzoic acid 0
                                            3-(5-amino-7-hydroxy-2H-[1,2,3]triazolo[4,5-d]pyrimidin-2-yl)benzoic acid 0
                                            3-aminobenzoic acid + 0
                                            3-bromo-4,5-dihydroxybenzoic acid 0
                                            3-bromo-4-hydroxybenzoic acid 0
                                            3-chlorobenzoic acid 0
                                            3-ethoxybenzoic acid 0
                                            3-hexaprenyl-4,5-dihydroxybenzoic acid 0
                                            3-hexaprenyl-4-hydroxy-5-methoxybenzoic acid 0
                                            3-hydroxybenzoic acid + 0
                                            3-oxalobenzoic acid 0
                                            4-(2-carboxyphenyl)-2-oxobut-3-enoic acid + 0
                                            4-(4-\{(2S,5S)-5-[2-(dibenzylamino)-2-oxoethyl]-2-heptyl-4-oxo-1,3-thiazolidin-3-yl\}butyl)benzoic acid 0
                                            4-(beta-D-glucosyloxy)benzoic acid 0
                                            4-[(2R)-2-(aminomethyl)-2-(hydroxymethyl)-5-oxopyrrolidin-1-yl]-3-[(1-ethylpropyl)amino]benzoic acid 0
                                            4-[2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-dioxolan-2-yl]benzoic acid 0
                                            4-\{5-[(Z)-(2-imino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl\}benzoic acid 0
                                            4-\{[(2R,5S)-5-\{[(2S)-2-(aminomethyl)pyrrolidin-1-yl]carbonyl\}pyrrolidin-2-yl]methoxy\}-3-tert-butylbenzoic acid 0
                                            4-aminobenzoic acid + 0
                                            4-chlorobenzoic acid + 0
                                            4-hydroxy-3-octaprenylbenzoic acid 0
                                            4-isothiocyanatobenzoic acid 0
                                            4-methoxybenzoic acid + 0
                                            4-nitrobenzoic acid + 0
                                            4-sulfobenzoic acid 0
                                            5-chlorosalicylic acid + 0
                                            5-sulfosalicylic acid 0
                                            N-benzoyl-D-arginines + 0
                                            N-benzoyl-L-arginine 0
                                            N-benzoyl-L-phenylalaninol + 0
                                            benzamidine 0
                                            benzohydrazide + 0
                                            benzoic anhydride + 0
                                            benzoyl chloride + 0
                                            benzoyl cyanide 0
                                            benzoyl group 0
                                            benzoyl-CoA + 0
                                            benzoyl-beta-D-glucoside 0
                                            benzoylacetonitrile 0
                                            benzoyloxy group 0
                                            benzyl benzoate 0
                                            carboxy-PTIO 0
                                            fluorobenzoic acid + 0
                                            geranyl benzoate 0
                                            hexadecyl benzoate 0
                                            hydroxybenzoic acid + 0
                                            isobutyl benzoate 0
                                            macrophomic acid 0
                                            metronidazole benzoate 0
                                            octyl benzoate 0
                                            p-chloromercuribenzoic acid 0
                                            p-mercuribenzoic acid 0
                                            pentafluorobenzoic acid + 0
                                            phenethyl benzoate 0
                                            tert-butyl benzoate 0
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