{"ymdb_id":"YMDB01364","created_at":"2011-07-25T20:22:47.000Z","updated_at":"2016-09-08T18:36:35.000Z","name":"Propyl decanoate","cas":"30673-60-0","state":null,"melting_point":null,"description":"Propyl decanoate is a volatile propyl ester found in wine and produced during fermentation by yeast. Propyl esters are formed by the reaction of propanol with a fatty acid. Propyl ester are far less common than ethyl esters that are produced from ethanol.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":"extracellular","synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"7799","cs_id":"108621","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"propyl decanoate","traditional_iupac":"propyl decanoate","logp":"4.614395193333333","pka":null,"alogps_solubility":"3.23e-03 g/l","alogps_logp":"5.32","alogps_logs":"-4.82","acceptor_count":"1","donor_count":"0","rotatable_bond_count":"11","polar_surface_area":"26.3","refractivity":"63.5193","polarizability":"27.7942316887813","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-7.032707675067303","pka_strongest_acidic":null,"bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"1","veber_rule":"0","mddr_like_rule":"0","synonyms":["n-propyl decanoate"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":20151225,"citation":"Tsakiris, A., Koutinas, A. A., Psarianos, C., Kourkoutas, Y., Bekatorou, A. (2010). \"A new process for wine production by penetration of yeast in uncrushed frozen grapes.\" Appl Biochem Biotechnol 162:1109-1121."}],"proteins":[]}