2.02012-07-30 14:55:05 -06002015-06-03 17:20:59 -0600ECMDB21242M2MDB001650L-Alanine-L-glutamateL-Alanine-L-glutamate is a dipeptide composed of alanine and glutamate. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.Ala-gluAlanine-glutamate dipeptideAlanine-glutamic acid dipeptideAlanyl-L-glutamateAlanyl-L-glutamic acidL-alanine-L-glutamateL-Alanine-L-glutamic acidC8H13N2O5217.1992217.082446536(4S)-4-{[(2S)-2-amino-1-hydroxypropylidene]amino}-4-carboxybutanoate(4S)-4-{[(2S)-2-amino-1-hydroxypropylidene]amino}-4-carboxybutanoate[H][C@@](C)(N)C(O)=N[C@@]([H])(CCC([O-])=O)C(O)=OInChI=1S/C8H14N2O5/c1-4(9)7(13)10-5(8(14)15)2-3-6(11)12/h4-5H,2-3,9H2,1H3,(H,10,13)(H,11,12)(H,14,15)/p-1/t4-,5-/m0/s1VYZAGTDAHUIRQA-WHFBIAKZSA-MCytoplasmlogp-3.07logs-1.30solubility1.17e+01 g/llogp-3.2pka_strongest_acidic3.58pka_strongest_basic9.57iupac(4S)-4-{[(2S)-2-amino-1-hydroxypropylidene]amino}-4-carboxybutanoateaverage_mass217.1992mono_mass217.082446536smiles[H][C@@](C)(N)C(O)=N[C@@]([H])(CCC([O-])=O)C(O)=OformulaC8H13N2O5inchiInChI=1S/C8H14N2O5/c1-4(9)7(13)10-5(8(14)15)2-3-6(11)12/h4-5H,2-3,9H2,1H3,(H,10,13)(H,11,12)(H,14,15)/p-1/t4-,5-/m0/s1inchikeyVYZAGTDAHUIRQA-WHFBIAKZSA-Mpolar_surface_area136.04refractivity59.94polarizability20.27rotatable_bond_count6acceptor_count7donor_count3physiological_charge-2formal_charge-1Specdb::NmrOneD293375Specdb::NmrOneD293376Specdb::NmrOneD293377Specdb::NmrOneD293378Specdb::NmrOneD293379Specdb::NmrOneD293380Specdb::NmrOneD293381Specdb::NmrOneD293382Specdb::NmrOneD293383Specdb::NmrOneD293384Specdb::NmrOneD293385Specdb::NmrOneD293386Specdb::NmrOneD293387Specdb::NmrOneD293388Specdb::NmrOneD293389Specdb::NmrOneD293390Specdb::NmrOneD293391Specdb::NmrOneD293392Specdb::NmrOneD293393Specdb::NmrOneD293394Specdb::MsMs24422Specdb::MsMs24423Specdb::MsMs24424Specdb::MsMs30980Specdb::MsMs30981Specdb::MsMs309827006474537072661396CPD0-1445Aminoacyl-histidine dipeptidaseP15288PEPD_ECOLIpepDhttp://ecmdb.ca/proteins/P15288.xmlL-Ala-D/L-Glu epimeraseP51981AEEP_ECOLIycjGhttp://ecmdb.ca/proteins/P51981.xmlDipeptide and tripeptide permease BP36837DTPB_ECOLIdtpBhttp://ecmdb.ca/proteins/P36837.xmlProbable dipeptide and tripeptide permease YjdLP39276YJDL_ECOLIyjdLhttp://ecmdb.ca/proteins/P39276.xmlDipeptide permease DP75742DTPD_ECOLIdtpDhttp://ecmdb.ca/proteins/P75742.xmlDipeptide and tripeptide permease AP77304DTPA_ECOLIdtpAhttp://ecmdb.ca/proteins/P77304.xmlOuter membrane protein NP77747OMPN_ECOLIompNhttp://ecmdb.ca/proteins/P77747.xmlOuter membrane pore protein EP02932PHOE_ECOLIphoEhttp://ecmdb.ca/proteins/P02932.xmlOuter membrane protein FP02931OMPF_ECOLIompFhttp://ecmdb.ca/proteins/P02931.xmlOuter membrane protein CP06996OMPC_ECOLIompChttp://ecmdb.ca/proteins/P06996.xmlL-Alanine-L-glutamate + Water > L-Alanine + L-GlutamateL-Alanyl-D-glutamate <> L-Alanine-L-glutamate