1.0 2016-09-30 23:07:52 UTC 2020-05-21 16:28:49 UTC BMDB0004089 BMDB04089 Formylanthranilic acid Formylanthranilic acid, also known as Formylanthranilic acid or Formylanthranilic acid, belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group. Formylanthranilic acid is possibly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Formylanthranilic acid exists in all living species, ranging from bacteria to humans. Formylanthranilic acid participates in a number of enzymatic reactions, within cattle. In particular, Formylanthranilic acid and L-alanine can be biosynthesized from n'-formylkynurenine through its interaction with the enzyme kynureninase. In addition, Formylanthranilic acid can be converted into 2-aminobenzoic acid and formic acid; which is mediated by the enzyme kynurenine formamidase. In cattle, formylanthranilic acid is involved in the metabolic pathway called the tryptophan metabolism pathway. 2-(Formylamino)-benzoic acid 2-(Formylamino)benzoic acid N-Formylanthranilate 2-(Formylamino)-benzoate 2-(Formylamino)benzoate N-Formylanthranilic acid Formylanthranilate 2-Formamidobenzoate 2-Formamidobenzoic acid C8H7NO3 165.1461 165.042593095 2-formamidobenzoic acid formylanthranilic acid 3342-77-6 OC(=O)C1=CC=CC=C1NC=O InChI=1S/C8H7NO3/c10-5-9-7-4-2-1-3-6(7)8(11)12/h1-5H,(H,9,10)(H,11,12) LLLPDUXGHXIXIW-UHFFFAOYSA-N belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl group. Organic compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives Benzoic acids Benzoyl derivatives Carboximidic acids Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Propargyl-type 1,3-dipolar organic compounds Aromatic homomonocyclic compound Benzoic acid Benzoyl Carboximidic acid Carboximidic acid derivative Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Monocarboxylic acid or derivatives Organic 1,3-dipolar compound Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Propargyl-type 1,3-dipolar organic compound Aromatic homomonocyclic compounds amidobenzoic acid Solid logp 0.28 ALOGPS logs -1.85 ALOGPS logp 1.47 ChemAxon pka_strongest_acidic 3.57 ChemAxon pka_strongest_basic -4.5 ChemAxon iupac 2-formamidobenzoic acid ChemAxon average_mass 165.1461 ChemAxon mono_mass 165.042593095 ChemAxon smiles OC(=O)C1=CC=CC=C1NC=O ChemAxon formula C8H7NO3 ChemAxon inchi InChI=1S/C8H7NO3/c10-5-9-7-4-2-1-3-6(7)8(11)12/h1-5H,(H,9,10)(H,11,12) ChemAxon inchikey LLLPDUXGHXIXIW-UHFFFAOYSA-N ChemAxon polar_surface_area 66.4 ChemAxon refractivity 43.69 ChemAxon polarizability 15.48 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon number_of_rings 1 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Tryptophan Metabolism SMP0087237 Specdb::CMs 3315 Specdb::CMs 38712 Specdb::CMs 132967 Specdb::CMs 140701 Specdb::MsIr 2123 Specdb::MsIr 2124 Specdb::MsIr 2125 Specdb::MsMs 179898 Specdb::MsMs 179899 Specdb::MsMs 179900 Specdb::MsMs 182232 Specdb::MsMs 182233 Specdb::MsMs 182234 Specdb::MsMs 2718324 Specdb::MsMs 2718325 Specdb::MsMs 2718326 Specdb::MsMs 2964117 Specdb::MsMs 2964118 Specdb::MsMs 2964119 Specdb::NmrOneD 41562 Specdb::NmrOneD 41563 Specdb::NmrOneD 41564 Specdb::NmrOneD 41565 Specdb::NmrOneD 41566 Specdb::NmrOneD 41567 Specdb::NmrOneD 41568 Specdb::NmrOneD 41569 Specdb::NmrOneD 41570 Specdb::NmrOneD 41571 Specdb::NmrOneD 41572 Specdb::NmrOneD 41573 Specdb::NmrOneD 41574 Specdb::NmrOneD 41575 Specdb::NmrOneD 41576 Specdb::NmrOneD 41577 Specdb::NmrOneD 41578 Specdb::NmrOneD 41579 Specdb::NmrOneD 41580 Specdb::NmrOneD 41581 FDB023309 91624 101399 C05653 36575 46205 Prashad, Mahavir; Har, Denis; Repic, Oljan; Blacklock, Thomas J.; Chin, Jefferson A.; Shapiro, Michael J. Reaction of benzoyleneurea and isatoic anhydride with the Vilsmeier reagent. Tetrahedron Letters (1997), 38(8), 1313-1316. BMDBP02928 Kynureninase F1MCH2 KYNU Enzyme BMDBP02929 Kynurenine formamidase E1BLL5 AFMID Enzyme