2.0 2015-06-04 16:09:23 -0600 2015-08-05 16:22:04 -0600 ECMDB23821 M2MDB004522 4-Hydroxybutanoic acid A Central Nervous System Depressant. The physiologic effect of 4-hydroxybutanoic acid is by means of Central Nervous System Depression and Decreased Central Nervous System Organized Electrical Activity. 3-Carboxypropoxy acid 4-Hydroxy-butanoate 4-Hydroxy-butanoic acid 4-Hydroxy-butyrate 4-Hydroxy-butyric acid 4-Hydroxyalkanoate 4-Hydroxyalkanoic acid 4-Hydroxybutanoate 4-Hydroxybutanoic acid 4-Hydroxybutyrate 4-Hydroxybutyrate monosodium salt 4-Hydroxybutyrate sodium 4-Hydroxybutyric acid 4-Hydroxybutyric acid monosodium salt 4-Hydroxybutyric acid sodium 4-Hydroxycarboxylate 4-Hydroxycarboxylic acid g Hydroxybutyrate g Hydroxybutyric acid g-Hydroxy butyrate g-Hydroxy butyric acid g-Hydroxy sodium butyrate g-Hydroxy sodium butyric acid g-Hydroxybutyrate g-Hydroxybutyrate sodium g-Hydroxybutyric acid g-Hydroxybutyric acid sodium gamma Hydroxybutyrate Gamma Hydroxybutyric acid gamma-Hydroxy butyrate gamma-Hydroxy butyric acid gamma-Hydroxy sodium butyrate gamma-Hydroxy sodium butyric acid gamma-Hydroxybutyrate gamma-Hydroxybutyrate sodium gamma-Hydroxybutyric acid gamma-Hydroxybutyric acid sodium GHB Hydroxybutyrate Hydroxybutyric acid Monosodium salt Oxy-N-butyrate Oxy-N-butyric acid Oxybate sodium Oxybic acid sodium Sodium g-hydroxybutyrate Sodium g-hydroxybutyric acid Sodium g-oxybutyrate Sodium g-oxybutyric acid Sodium gamma-hydroxybutyrate Sodium gamma-hydroxybutyric acid Sodium gamma-oxybutyrate Sodium gamma-oxybutyric acid Sodium oxybate Sodium oxybic acid Sodium γ-hydroxybutyrate Sodium γ-hydroxybutyric acid Sodium γ-oxybutyrate Sodium γ-oxybutyric acid Xyrem γ hydroxybutyrate γ hydroxybutyric acid γ-Hydroxy butyrate γ-Hydroxy butyric acid γ-Hydroxy sodium butyrate γ-Hydroxy sodium butyric acid γ-hydroxybutyrate γ-Hydroxybutyrate sodium γ-hydroxybutyric acid γ-Hydroxybutyric acid sodium C4H8O3 104.1045 104.047344122 4-hydroxybutanoic acid gamma hydroxybutyric acid 591-81-1 OCCCC(O)=O InChI=1S/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7) SJZRECIVHVDYJC-UHFFFAOYSA-N logp -0.63 ALOGPS logs 0.68 ALOGPS solubility 4.94e+02 g/l ALOGPS logp -0.51 ChemAxon pka_strongest_acidic 4.44 ChemAxon pka_strongest_basic -2.4 ChemAxon iupac 4-hydroxybutanoic acid ChemAxon average_mass 104.1045 ChemAxon mono_mass 104.047344122 ChemAxon smiles OCCCC(O)=O ChemAxon formula C4H8O3 ChemAxon inchi InChI=1S/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7) ChemAxon inchikey SJZRECIVHVDYJC-UHFFFAOYSA-N ChemAxon polar_surface_area 57.53 ChemAxon refractivity 23.8 ChemAxon polarizability 10.17 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Butanoate metabolism ec00650 Metabolic pathways eco01100 Specdb::CMs 986 Specdb::CMs 14061 Specdb::CMs 31203 Specdb::CMs 32047 Specdb::CMs 37710 Specdb::CMs 135411 Specdb::CMs 143145 Specdb::CMs 1072680 Specdb::CMs 1072682 Specdb::CMs 1072684 Specdb::CMs 1072685 Specdb::CMs 1072687 Specdb::EiMs 314 Specdb::NmrOneD 256408 Specdb::NmrOneD 256409 Specdb::NmrOneD 256410 Specdb::NmrOneD 256411 Specdb::NmrOneD 256412 Specdb::NmrOneD 256413 Specdb::NmrOneD 256414 Specdb::NmrOneD 256415 Specdb::NmrOneD 256416 Specdb::NmrOneD 256417 Specdb::NmrOneD 256418 Specdb::NmrOneD 256419 Specdb::NmrOneD 256420 Specdb::NmrOneD 256421 Specdb::NmrOneD 256422 Specdb::NmrOneD 256423 Specdb::NmrOneD 256424 Specdb::NmrOneD 256425 Specdb::NmrOneD 256426 Specdb::NmrOneD 256427 Specdb::MsMs 26384 Specdb::MsMs 26385 Specdb::MsMs 26386 Specdb::MsMs 32942 Specdb::MsMs 32943 Specdb::MsMs 32944 Specdb::MsMs 1470825 Specdb::MsMs 1472610 Specdb::MsMs 1472611 Specdb::MsMs 1472612 Specdb::MsMs 1472613 Specdb::MsMs 1472614 Specdb::MsMs 1472615 Specdb::MsMs 1472616 Specdb::MsMs 1472617 Specdb::MsMs 1472618 Specdb::MsMs 1472619 Specdb::MsMs 1472620 Specdb::MsMs 1472621 Specdb::MsMs 1472622 Specdb::MsMs 1472623 Specdb::MsMs 1472624 Specdb::MsMs 1472625 Specdb::MsMs 1472626 Specdb::MsMs 1477816 C00989 Uncharacterized oxidoreductase yihU P0A9V8 YIHU_ECOLI yihU http://ecmdb.ca/proteins/P0A9V8.xml 4-Hydroxybutanoic acid + NAD <> Succinic acid semialdehyde + NADH + Hydrogen ion R01644