{"ymdb_id":"YMDB00839","created_at":"2011-05-29T18:57:16.000Z","updated_at":"2016-09-08T18:35:58.000Z","name":"all-trans-Hexaprenyl diphosphate","cas":null,"state":"Solid","melting_point":null,"description":"all-trans-Hexaprenyl diphosphate is a substrate in the ubiquinol-6 biosynthesis (eukaryotic) pathway. Ubiquinone (coenzyme Q) is an isoprenoid quinone that functions as an electron carrier in membranes. [Biocyc PWY3O-19]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"17528","hmdb_id":"HMDB12188","kegg_id":"C01230","pubchem_id":"202","cs_id":"24808229","foodb_id":null,"wikipedia_link":null,"biocyc_id":"ALL-TRANS-HEXAPRENYL-DIPHOSPHATE","iupac":"[({[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]oxy}(hydroxy)phosphoryl)oxy]phosphonic acid","traditional_iupac":"{[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]oxy(hydroxy)phosphoryl}oxyphosphonic acid","logp":"8.595875885666667","pka":"3.2043406094078315","alogps_solubility":"7.15e-04 g/l","alogps_logp":"5.95","alogps_logs":"-5.91","acceptor_count":"5","donor_count":"3","rotatable_bond_count":"20","polar_surface_area":"113.29000000000002","refractivity":"168.13830000000002","polarizability":"67.36499667038598","formal_charge":"0","physiological_charge":"-2","pka_strongest_basic":null,"pka_strongest_acidic":"1.7672186885241006","bioavailability":"0","number_of_rings":"0","rule_of_five":"0","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl trihydrogen diphosphate","(E)-hexaprenyl diphosphate","all-trans-hexaprenyl diphosphate"],"pathways":[{"name":"Terpenoid backbone biosynthesis","kegg_map_id":"00900"},{"name":"Ubiquinone and other terpenoid-quinone biosynthesis","kegg_map_id":"00130"},{"name":"Ubiquinone Biosynthesis","kegg_map_id":null}],"growth_conditions":[],"references":[{"pubmed_id":21062828,"citation":"Scheer, M., Grote, A., Chang, A., Schomburg, I., Munaretto, C., Rother, M., Sohngen, C., Stelzer, M., Thiele, J., Schomburg, D. (2011). \"BRENDA, the enzyme information system in 2011.\" Nucleic Acids Res 39:D670-D676."}],"proteins":[]}