{"ymdb_id":"YMDB01565","created_at":"2011-08-11T21:20:05.000Z","updated_at":"2016-10-18T17:12:05.000Z","name":"Anserine","cas":"584-85-0","state":"Solid","melting_point":"226-228 oC","description":"Anserine (beta-alanyl-N-methylhistidine) is a dipeptide of beta-alanine and N-methyl-histidine related to the dipeptide carnosine (beta-alanyl-L-histidine). Anserine has been documented in the skeletal muscle and brain of mammals.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"18323","hmdb_id":"HMDB00194","kegg_id":"C01262","pubchem_id":"112072","cs_id":"100482","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(2S)-2-(3-aminopropanamido)-3-(1-methyl-1H-imidazol-5-yl)propanoic acid","traditional_iupac":"anserine","logp":"-4.26466129830276","pka":"13.7461992021571","alogps_solubility":"4.01e+00 g/l","alogps_logp":"-2.95","alogps_logs":"-1.78","acceptor_count":"5","donor_count":"3","rotatable_bond_count":"6","polar_surface_area":"110.24","refractivity":"60.458600000000004","polarizability":"24.30257648493638","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"9.125526276418753","pka_strongest_acidic":"3.4429691588256897","bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["b-Alanyl-3-methyl-L-histidine","b-Alanyl-N(pai)-methyl-L-histidine","Balanine","Beta Alanyl 3 methylhistidine","beta-Alanyl-3-methyl-L-histidine","Beta-Alanyl-3-methylhistidine","beta-Alanyl-N(pai)-methyl-L-histidine","L-Anserine","L-N-b-Alanyl-3-methyl-histidine","L-N-beta-Alanyl-3-methyl-histidine","N-b-Alanyl-3-methyl-L-histidine","N-beta-Alanyl-3-methyl-L-histidine","Ophidine","β-alanyl-3-methyl-L-histidine","β-alanyl-N(pai)-methyl-L-histidine"],"pathways":[],"growth_conditions":[{"growth_media":"YEB media with 0.5 mM glucose","concentration":"840.0","concentration_units":"\u0026#181;M","error":"42.0"}],"references":[],"proteins":[]}