2.02015-06-04 15:19:26 -06002015-08-05 16:22:04 -0600ECMDB23798M2MDB004380GlufosinateConjugate base of phosphinothricin arising from deprotonation of the phosphinate function(2S)-2-amino-4-(Hydroxyphosphinyl)butanoate(2S)-2-amino-4-(Hydroxyphosphinyl)butanoic acidGlufosinic acidC4H10NO4P167.101167.034744804(2S)-2-amino-4-(hydroxyphosphonoyl)butanoic acid(2S)-2-amino-4-(hydroxyphosphonoyl)butanoic acid51276-47-2[H]P(O)(=O)CC[C@H](N)C(O)=OInChI=1S/C4H10NO4P/c5-3(4(6)7)1-2-10(8)9/h3,10H,1-2,5H2,(H,6,7)(H,8,9)/t3-/m0/s1IDBRULKICVRMNG-VKHMYHEASA-Nlogp-2.78logs-0.67solubility3.58e+01 g/llogp-4pka_strongest_acidic1.98pka_strongest_basic9.53iupac(2S)-2-amino-4-(hydroxyphosphonoyl)butanoic acidaverage_mass167.101mono_mass167.034744804smiles[H]P(O)(=O)CC[C@H](N)C(O)=OformulaC4H10NO4PinchiInChI=1S/C4H10NO4P/c5-3(4(6)7)1-2-10(8)9/h3,10H,1-2,5H2,(H,6,7)(H,8,9)/t3-/m0/s1inchikeyIDBRULKICVRMNG-VKHMYHEASA-Npolar_surface_area100.62refractivity34.52polarizability14.15rotatable_bond_count4acceptor_count5donor_count3physiological_charge-1formal_charge0Phosphonate and phosphinate metabolismec00440Specdb::CMs1084663Specdb::NmrOneD286755Specdb::NmrOneD286756Specdb::NmrOneD286757Specdb::NmrOneD286758Specdb::NmrOneD286759Specdb::NmrOneD286760Specdb::NmrOneD286761Specdb::NmrOneD286762Specdb::NmrOneD286763Specdb::NmrOneD286764Specdb::NmrOneD286765Specdb::NmrOneD286766Specdb::NmrOneD286767Specdb::NmrOneD286768Specdb::NmrOneD286769Specdb::NmrOneD286770Specdb::NmrOneD286771Specdb::NmrOneD286772Specdb::NmrOneD286773Specdb::NmrOneD286774Specdb::MsMs27752Specdb::MsMs27753Specdb::MsMs27754Specdb::MsMs34310Specdb::MsMs34311Specdb::MsMs34312C05042predicted acyltransferase with acyl-CoA N-acyltransferase domainP76112yncAhttp://ecmdb.ca/proteins/P76112.xmlAcetyl-CoA + + Glufosinate <> Coenzyme A + N-Acetylphosphinothricin + N-AcetylphosphinothricinR08938