{"ymdb_id":"YMDB01535","created_at":"2011-08-11T20:15:31.000Z","updated_at":"2016-10-18T17:12:04.000Z","name":"9,12-Hexadecadienylcarnitine","cas":null,"state":"Solid","melting_point":null,"description":"9,12-Hexadecadienoylcarnitine is a long-chain fatty acid ester of carnitine with 9,12-Hexadecadienoic acid. Carnitine is used for the transport of fatty acids during beta-oxidation, during what fatty acids are broken down to acetyl-CoA. Acetyl-CoA is then used in the glyoxylate cycle for gluconeogenesis and formation of carbohydrates, or transported to mitochondrion for the generation of metabolic energy through the citric acid cycle. [Biocyc PWY-6111] ","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":"HMDB13334","kegg_id":null,"pubchem_id":"18618540","cs_id":null,"foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(4S)-4-(hexadeca-9,12-dienoyloxy)-4-(trimethylazaniumyl)butanoate","traditional_iupac":"(4S)-4-(hexadeca-9,12-dienoyloxy)-4-(trimethylammonio)butanoate","logp":"1.6357752801949204","pka":null,"alogps_solubility":"1.55e-05 g/l","alogps_logp":"0.54","alogps_logs":"-7.46","acceptor_count":"3","donor_count":"0","rotatable_bond_count":"18","polar_surface_area":"66.43","refractivity":"139.24269999999996","polarizability":"47.487926808194096","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-7.185041591485152","pka_strongest_acidic":"4.17471681475821","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":[],"pathways":[],"growth_conditions":[{"growth_media":"YEB media with 0.5 mM glucose","concentration":"0.2","concentration_units":"\u0026#181;M","error":"0.0"}],"references":[],"proteins":[]}