{"ymdb_id":"YMDB01623","created_at":"2011-08-31T03:29:19.000Z","updated_at":"2016-09-08T18:36:54.000Z","name":"4-Nonanolide","cas":"104-61-0","state":"Solid","melting_point":null,"description":"4-Nonanolide is a compound responsible for coconut aromas.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":"C08501","pubchem_id":"7710","cs_id":"7424","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"5-pentyloxolan-2-one","traditional_iupac":"5-pentyloxolan-2-one","logp":"2.422354720333333","pka":null,"alogps_solubility":"5.79e-01 g/l","alogps_logp":"2.41","alogps_logs":"-2.43","acceptor_count":"1","donor_count":"0","rotatable_bond_count":"4","polar_surface_area":"26.3","refractivity":"43.0539","polarizability":"18.327496484601895","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-7.042552424460948","pka_strongest_acidic":null,"bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"1","mddr_like_rule":"0","synonyms":["(3H)-Dihydro-5-pentyl-2-furanone","1,4-Nonalolide","4-Hydroxynonanoic acid lactone","4-Hydroxynonanoic acid, \u0026laquo","4-Nonanolide","4-Pentylbutanolide","5-Pentyl-\u0026laquo","5-Pentyldihydro-2(3H)-furanone","5-Pentyldihydrofuran-2(3H)-one","Aldehyde C-18","Dihydro-5-pentyl-2(3H)-furanon","dihydro-5-pentyl-2(3H)-furanone","gamma-Nonalactone","Nonan-1,4-olide","nonan-4-olide","Nonanoic acid, 4-hydroxy-, \u0026laquo","Nonlacton","Nonlakton","Prunolide"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":17616208,"citation":"Loscos, N., Hernandez-Orte, P., Cacho, J., Ferreira, V. (2007). \"Release and formation of varietal aroma compounds during alcoholic fermentation from nonfloral grape odorless flavor precursors fractions.\" J Agric Food Chem 55:6674-6684."}],"proteins":[]}