{"ymdb_id":"YMDB01456","created_at":"2011-07-25T20:40:05.000Z","updated_at":"2016-09-08T18:36:42.000Z","name":"cis-3,5-Dimethyl-1,2,4-trithiolane","cas":"5616-51-3","state":null,"melting_point":null,"description":"cis-3,5-Dimethyl-1,2,4-trithiolane is a volatile aroma compound found in yeast extracts.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"21828","cs_id":"4933290","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(3R,5S)-3,5-dimethyl-1,2,4-trithiolane","traditional_iupac":"(3R,5S)-3,5-dimethyl-1,2,4-trithiolane","logp":"2.030678283","pka":null,"alogps_solubility":"4.26e-01 g/l","alogps_logp":"1.97","alogps_logs":"-2.55","acceptor_count":"0","donor_count":"0","rotatable_bond_count":"0","polar_surface_area":"0","refractivity":"41.775299999999994","polarizability":"15.544109622185758","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":null,"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":["1,3-Dithiolane, 2-methyl-","2-Methyl-1,3-dithiolane"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":16968089,"citation":"Mahadevan, K., Farmer, L. (2006). \"Key odor impact compounds in three yeast extract pastes.\" J Agric Food Chem 54:7242-7250."}],"proteins":[]}