1.0 2010-04-08 22:09:29 UTC 2019-11-26 03:04:36 UTC FDB011137 2-Amino-4-hydroxy-6-pteridinecarboxylic acid Isolated from various biol. sources including fish and soybeans. 2-Amino-4-hydroxy-6-pteridinecarboxylic acid is found in fishes and pulses. 2-Amino-1,4-dihydro-4-oxo-6-pteridinecarboxylic acid 2-Amino-1,4-dihydro-4-oxopteridine-6-carboxylic acid 2-Amino-4-hydroxypteridine-6-carboxylic acid 2-Amino-4-hydroxypteridine-6-carboxylicacid 2-Amino-4-oxo-3,4-dihydro-6-pteridinecarboxylic acid 2-Amino-4(3H)-pteridinone-6-carboxylic acid HHS Pterin-6-carboxylic acid Pterine-6-carboxylic acid Ranachrome 5 C7H5N5O3 207.1463 207.039239051 2-amino-4-oxo-3,4-dihydropteridine-6-carboxylic acid 2-amino-4-oxo-3H-pteridine-6-carboxylic acid 948-60-7 NC1=NC2=NC=C(N=C2C(=O)N1)C(O)=O InChI=1S/C7H5N5O3/c8-7-11-4-3(5(13)12-7)10-2(1-9-4)6(14)15/h1H,(H,14,15)(H3,8,9,11,12,13) QABAUCFGPWONOG-UHFFFAOYSA-N belongs to the class of organic compounds known as pterin carboxylates. These are heterocyclic aromatic compounds containing a pterin moiety, in which one ring is substituted by one or more carboxylic acid groups. Pterin is a heterocyclic compound composed of a pteridine ring system (made up of a pyrazine fused to a pyrimidine), with a keto group and an amino group at the 2- and 4- positions, respectively. Pterin carboxylates Organic compounds Organoheterocyclic compounds Pteridines and derivatives Pterins and derivatives Aromatic heteropolycyclic compounds Azacyclic compounds Carboxylic acids Heteroaromatic compounds Hydrocarbon derivatives Hydroxypyrimidines Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds Pyrazine carboxylic acids Aromatic heteropolycyclic compound Azacycle Carboxylic acid Carboxylic acid derivative Heteroaromatic compound Hydrocarbon derivative Hydroxypyrimidine Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Pterin-6-carboxylate Pyrazine Pyrazine carboxylic acid Pyrazine carboxylic acid or derivatives Pyrimidine logp -1.45 ALOGPS logs -2.16 ALOGPS solubility 1.45e+00 g/l ALOGPS melting_point Mp 360° logp -0.91 ChemAxon pka_strongest_acidic 3.44 ChemAxon pka_strongest_basic 0.48 ChemAxon iupac 2-amino-4-oxo-3,4-dihydropteridine-6-carboxylic acid ChemAxon average_mass 207.1463 ChemAxon mono_mass 207.039239051 ChemAxon smiles NC1=NC2=NC=C(N=C2C(=O)N1)C(O)=O ChemAxon formula C7H5N5O3 ChemAxon inchi InChI=1S/C7H5N5O3/c8-7-11-4-3(5(13)12-7)10-2(1-9-4)6(14)15/h1H,(H,14,15)(H3,8,9,11,12,13) ChemAxon inchikey QABAUCFGPWONOG-UHFFFAOYSA-N ChemAxon polar_surface_area 130.56 ChemAxon refractivity 48.7 ChemAxon polarizability 17.78 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 7 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12709 Specdb::CMs 43112 Specdb::CMs 133389 Specdb::CMs 141123 Specdb::MsIr 5988 Specdb::MsIr 5989 Specdb::MsIr 5990 Specdb::MsMs 12143 Specdb::MsMs 12144 Specdb::MsMs 12145 Specdb::MsMs 18815 Specdb::MsMs 18816 Specdb::MsMs 18817 Specdb::MsMs 2442136 Specdb::MsMs 2442137 Specdb::MsMs 2442138 Specdb::MsMs 2520152 Specdb::MsMs 2520153 Specdb::MsMs 2520154 Specdb::NmrOneD 118258 Specdb::NmrOneD 118259 Specdb::NmrOneD 118260 Specdb::NmrOneD 118261 Specdb::NmrOneD 118262 Specdb::NmrOneD 118263 Specdb::NmrOneD 118264 Specdb::NmrOneD 118265 Specdb::NmrOneD 118266 Specdb::NmrOneD 118267 Specdb::NmrOneD 118268 Specdb::NmrOneD 118269 Specdb::NmrOneD 118270 Specdb::NmrOneD 118271 Specdb::NmrOneD 118272 Specdb::NmrOneD 118273 Specdb::NmrOneD 118274 Specdb::NmrOneD 118275 Specdb::NmrOneD 118276 Specdb::NmrOneD 118277 HMDB33136 #<Reference:0x000055ce322df838> Fishes Unknown generic Pulses Unknown generic