1.0 2010-04-08 22:14:28 UTC 2019-11-26 03:17:42 UTC FDB019618 Carotamine Isolated from carrots. Carotamine is found in root vegetables. 2-Amino-4-(4-aminobenzoylamino)benzoic acid Carotamine C14H13N3O3 271.2713 271.095691297 2-amino-4-(4-aminobenzamido)benzoic acid 2-amino-4-(4-aminobenzamido)benzoic acid NC1=CC=C(C=C1)C(=O)NC1=CC=C(C(O)=O)C(N)=C1 InChI=1S/C14H13N3O3/c15-9-3-1-8(2-4-9)13(18)17-10-5-6-11(14(19)20)12(16)7-10/h1-7H,15-16H2,(H,17,18)(H,19,20) GGUOSFAJMKBDFW-UHFFFAOYSA-N belongs to the class of organic compounds known as benzanilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with a benzene ring. They have the general structure RNC(=O)R', where R,R'= benzene. Benzanilides Organic compounds Benzenoids Benzene and substituted derivatives Anilides Aromatic homomonocyclic compounds Amino acids Aminobenzoic acids Aniline and substituted anilines Benzamides Benzoic acids Benzoyl derivatives Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organooxygen compounds Organopnictogen compounds Primary amines Secondary carboxylic acid amides Vinylogous amides Amine Amino acid Amino acid or derivatives Aminobenzoic acid Aminobenzoic acid or derivatives Aniline or substituted anilines Aromatic homomonocyclic compound Benzamide Benzanilide Benzoic acid Benzoic acid or derivatives Benzoyl Carboxamide group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary amine Secondary carboxylic acid amide Vinylogous amide logp 1.10 ALOGPS logs -3.32 ALOGPS solubility 1.30e-01 g/l ALOGPS logp 1.71 ChemAxon pka_strongest_acidic 4.85 ChemAxon pka_strongest_basic 2.79 ChemAxon iupac 2-amino-4-(4-aminobenzamido)benzoic acid ChemAxon average_mass 271.2713 ChemAxon mono_mass 271.095691297 ChemAxon smiles NC1=CC=C(C=C1)C(=O)NC1=CC=C(C(O)=O)C(N)=C1 ChemAxon formula C14H13N3O3 ChemAxon inchi InChI=1S/C14H13N3O3/c15-9-3-1-8(2-4-9)13(18)17-10-5-6-11(14(19)20)12(16)7-10/h1-7H,15-16H2,(H,17,18)(H,19,20) ChemAxon inchikey GGUOSFAJMKBDFW-UHFFFAOYSA-N ChemAxon polar_surface_area 118.44 ChemAxon refractivity 78.25 ChemAxon polarizability 28 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 5 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11941 Specdb::CMs 46655 Specdb::CMs 132460 Specdb::CMs 140194 Specdb::MsMs 78876 Specdb::MsMs 78877 Specdb::MsMs 78878 Specdb::MsMs 139356 Specdb::MsMs 139357 Specdb::MsMs 139358 Specdb::MsMs 2301624 Specdb::MsMs 2301625 Specdb::MsMs 2301626 Specdb::MsMs 3063961 Specdb::MsMs 3063962 Specdb::MsMs 3063963 HMDB39955 #<Reference:0x000055ce319e5318> Root vegetables Unknown generic