1.0 2011-09-21 00:19:19 UTC 2015-10-09 22:31:31 UTC FDB022771 3-Aminosalicylic acid 3-Aminosalicylic acid is a derivative of salicylic acid, a common anti-inflammatory drug. [HMDB] 3-Amino Salicylate 3-Amino Salicylic acid 3-amino-(8CI)salicylate 3-amino-(8CI)salicylic acid 3-amino-2-hydroxy-(9CI)benzoate 3-amino-2-hydroxy-(9CI)benzoic acid 3-amino-2-hydroxy-benzoate 3-amino-2-hydroxy-benzoic acid 3-Amino-2-hydroxybenzoate 3-Amino-2-hydroxybenzoic acid 3-amino-salicylate 3-amino-salicylic acid 3-Aminosalicylate Desacetyleupaserrin Parasal Paser C7H7NO3 153.1354 153.042593095 3-amino-2-hydroxybenzoic acid 3-aminosalicylic acid 570-23-0 NC1=CC=CC(C(O)=O)=C1O InChI=1S/C7H7NO3/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,9H,8H2,(H,10,11) IQGMRVWUTCYCST-UHFFFAOYSA-N belongs to the class of organic compounds known as aminosalicylic acids. These are salicylic acids carrying an amino group on the benzene ring. Aminosalicylic acids Organic compounds Benzenoids Benzene and substituted derivatives Benzoic acids and derivatives Aromatic homomonocyclic compounds 1-hydroxy-4-unsubstituted benzenoids 3-aminosalicylic acids Amino acids Aminobenzoic acids Aniline and substituted anilines Benzoic acids Benzoyl derivatives Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Organooxygen compounds Organopnictogen compounds Primary amines Salicylic acids Vinylogous acids o-Aminophenols 1-hydroxy-4-unsubstituted benzenoid 3-aminosalicylic acid Amine Amino acid Amino acid or derivatives Aminobenzoic acid Aminobenzoic acid or derivatives Aminophenol Aminosalicylic acid Aniline or substituted anilines Aromatic homomonocyclic compound Benzoic acid Benzoyl Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Monocarboxylic acid or derivatives O-aminophenol Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol Primary amine Salicylic acid Vinylogous acid Solid logp 0.84 ALOGPS logs -1.17 ALOGPS solubility 1.04e+01 g/l ALOGPS logp 0.27 ChemAxon pka_strongest_acidic 2.9 ChemAxon pka_strongest_basic 4.17 ChemAxon iupac 3-amino-2-hydroxybenzoic acid ChemAxon average_mass 153.1354 ChemAxon mono_mass 153.042593095 ChemAxon smiles NC1=CC=CC(C(O)=O)=C1O ChemAxon formula C7H7NO3 ChemAxon inchi InChI=1S/C7H7NO3/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,9H,8H2,(H,10,11) ChemAxon inchikey IQGMRVWUTCYCST-UHFFFAOYSA-N ChemAxon polar_surface_area 83.55 ChemAxon refractivity 40 ChemAxon polarizability 14.21 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13051 Specdb::CMs 38205 Specdb::CMs 147070 Specdb::NmrTwoD 1765 Specdb::MsIr 1496 Specdb::MsIr 1497 Specdb::MsIr 1498 Specdb::MsMs 1914 Specdb::MsMs 1915 Specdb::MsMs 1916 Specdb::MsMs 294661 Specdb::MsMs 294662 Specdb::MsMs 294663 Specdb::MsMs 335449 Specdb::MsMs 335450 Specdb::MsMs 335451 Specdb::MsMs 2257164 Specdb::MsMs 2259101 Specdb::MsMs 2259444 Specdb::MsMs 2388023 Specdb::MsMs 2388024 Specdb::MsMs 2388025 Specdb::MsMs 2573893 Specdb::MsMs 2573894 Specdb::MsMs 2573895 Specdb::NmrOneD 1825 Specdb::NmrOneD 102818 Specdb::NmrOneD 102819 Specdb::NmrOneD 102820 Specdb::NmrOneD 102821 Specdb::NmrOneD 102822 Specdb::NmrOneD 102823 Specdb::NmrOneD 102824 Specdb::NmrOneD 102825 Specdb::NmrOneD 102826 Specdb::NmrOneD 102827 Specdb::NmrOneD 102828 Specdb::NmrOneD 102829 Specdb::NmrOneD 102830 Specdb::NmrOneD 102831 Specdb::NmrOneD 102832 Specdb::NmrOneD 102833 Specdb::NmrOneD 102834 Specdb::NmrOneD 102835 Specdb::NmrOneD 102836 Specdb::NmrOneD 102837 HMDB01972 Arylacetamide deacetylase P22760 AADAC Arylamine N-acetyltransferase 1 P18440 NAT1 Arylamine N-acetyltransferase 2 P11245 NAT2