{"ymdb_id":"YMDB01678","created_at":"2011-08-31T03:34:51.000Z","updated_at":"2016-09-08T18:36:59.000Z","name":"E-Linalool oxide","cas":"34995-77-2","state":null,"melting_point":null,"description":"E-Linalool oxide is a compound responsible for a hay-like aroma.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":null,"cs_id":null,"foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-2-ol","traditional_iupac":"2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-2-ol","logp":"1.6687572143333338","pka":null,"alogps_solubility":"1.50e+00 g/l","alogps_logp":"1.51","alogps_logs":"-2.05","acceptor_count":"2","donor_count":"1","rotatable_bond_count":"2","polar_surface_area":"29.46","refractivity":"49.0441","polarizability":"19.523255352320202","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-3.0942487138516057","pka_strongest_acidic":"14.32453426188476","bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"1","veber_rule":"1","mddr_like_rule":"0","synonyms":["(E)-furan linalool oxide","(E)-furanoid linalool oxide","(E)-Linalol furanoxide","(E)-linalol oxide","(E)-Linalol oxide (furanoid)","(E)-Linalool furanoxide","(E)-Linalool oxide","(E)-linalool oxide A","(E)-linalool oxide, furanoid","2-(5-Methyl-5-vinyltetrahydro-2-furanyl)-2-propanol","E-linalool oxide (furan)","linalool oxide (trans-THF)","linalool oxide A (trans-THF)","linalool oxide furanoside I","linalool oxide II (trans furanoid)","Linalool oxide trans","Linalool oxide, trans-furanoid","oxide","oxides","t-Furan linalool oxide","t-Linalool oxide","tetrahydro-alpha,alpha,5-trimethyl-5-vinylfuran-2-methanol","Trans linalol furanoxide","trans-5-Trimethyl-2-furanmethanol","trans-furan linalool oxide","trans-furanic linalool oxid","trans-furanic linalool oxide","trans-Linalol oxide","trans-Linalol oxide (f)","trans-Linalol oxide (furanoid)","trans-Linalol oxide fur.","trans-linalool furan oxide","trans-linalool furanoid oxide","trans-linalool oxide","trans-Linalool oxide (f)","trans-Linalool oxide (furan type)","trans-Linalool oxide (furan)","Trans-linalool oxide (furanoid form)","trans-linalool oxide (furanoid)","trans-Linalool oxide (furanyl ring)","trans-Linalool oxide THF"],"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":[]}