{"ymdb_id":"YMDB01497","created_at":"2011-07-25T20:45:54.000Z","updated_at":"2016-09-08T18:36:45.000Z","name":"3-Methyl-1,2,4-trithiane","cas":"43040-01-3","state":null,"melting_point":null,"description":"3-Methyl-1,2,4-trithiane is a cysteine derived Maillard product. It is found in roasted sesame seed oil, yeast extracts and durian fruit.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"65290","cs_id":"58781","foodb_id":"FDB016309","wikipedia_link":null,"biocyc_id":null,"iupac":"3-methyl-1,2,4-trithiane","traditional_iupac":"3-methyl-1,2,4-trithiane","logp":"1.6165206570000001","pka":null,"alogps_solubility":"4.62e-01 g/l","alogps_logp":"1.72","alogps_logs":"-2.52","acceptor_count":"0","donor_count":"0","rotatable_bond_count":"0","polar_surface_area":"0","refractivity":"42.2239","polarizability":"15.47079542239525","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":["1,2,4-Trithiane, 3-methyl","3-Methyl-1,2,4-trithiacyclohexane","FEMA 3718"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":null,"citation":"Yannai S. Dictionary of food compounds with CD-ROM: additives, flavors, and ingredients. Chapman \u0026 Hall/CRC; 2004."}],"proteins":[]}