1.0 2016-09-30 23:26:22 UTC 2020-05-21 16:28:36 UTC BMDB0006818 BMDB06818 2-Hexaprenyl-6-methoxy-1,4-benzoquinone 2-Hexaprenyl-6-methoxy-1,4-benzoquinone belongs to the class of organic compounds known as polyprenylbenzoquinones. Polyprenylbenzoquinones are compounds containing a polyisoprene chain attached to a quinone at the second ring position. 2-Hexaprenyl-6-methoxy-1,4-benzoquinone is possibly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 2-Hexaprenyl-6-methoxy-1,4-benzoquinone exists in all eukaryotes, ranging from yeast to humans. In cattle, 2-hexaprenyl-6-methoxy-1,4-benzoquinone is involved in the metabolic pathway called ubiquinone biosynthesis pathway. 2-Polyprenyl-6-methoxy-1,4-benzoquinol DDMQH2 C37H54O3 546.8229 546.407295594 2-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-6-methoxycyclohexa-2,5-diene-1,4-dione 2-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-6-methoxycyclohexa-2,5-diene-1,4-dione COC1=CC(=O)C=C(C\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)C1=O InChI=1S/C37H54O3/c1-28(2)14-9-15-29(3)16-10-17-30(4)18-11-19-31(5)20-12-21-32(6)22-13-23-33(7)24-25-34-26-35(38)27-36(40-8)37(34)39/h14,16,18,20,22,24,26-27H,9-13,15,17,19,21,23,25H2,1-8H3/b29-16+,30-18+,31-20+,32-22+,33-24+ SCPRZSDIZDIQOW-FRICUITQSA-N belongs to the class of organic compounds known as polyprenylbenzoquinones. Polyprenylbenzoquinones are compounds containing a polyisoprene chain attached to a quinone at the second ring position. Organic compounds Lipids and lipid-like molecules Prenol lipids Quinone and hydroquinone lipids Polyprenylbenzoquinones Hydrocarbon derivatives Organic oxides P-benzoquinones Sesterterpenoids Vinylogous esters Aliphatic homomonocyclic compound Carbonyl group Cyclic ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound P-benzoquinone Polyprenylbenzoquinone Quinone Sesterterpenoid Vinylogous ester Aliphatic homomonocyclic compounds polyprenylbenzoquinone Solid logp 8.41 ALOGPS logs -6.18 ALOGPS logp 10.53 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac 2-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-6-methoxycyclohexa-2,5-diene-1,4-dione ChemAxon average_mass 546.8229 ChemAxon mono_mass 546.407295594 ChemAxon smiles COC1=CC(=O)C=C(C\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)C1=O ChemAxon formula C37H54O3 ChemAxon inchi InChI=1S/C37H54O3/c1-28(2)14-9-15-29(3)16-10-17-30(4)18-11-19-31(5)20-12-21-32(6)22-13-23-33(7)24-25-34-26-35(38)27-36(40-8)37(34)39/h14,16,18,20,22,24,26-27H,9-13,15,17,19,21,23,25H2,1-8H3/b29-16+,30-18+,31-20+,32-22+,33-24+ ChemAxon inchikey SCPRZSDIZDIQOW-FRICUITQSA-N ChemAxon polar_surface_area 43.37 ChemAxon refractivity 180.32 ChemAxon polarizability 69.04 ChemAxon rotatable_bond_count 18 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 1 ChemAxon bioavailability 0 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Ubiquinone Biosynthesis SMP0087215 Specdb::CMs 10587 Specdb::MsMs 178191 Specdb::MsMs 178192 Specdb::MsMs 178193 Specdb::MsMs 180507 Specdb::MsMs 180508 Specdb::MsMs 180509 Specdb::MsMs 2329341 Specdb::MsMs 2329342 Specdb::MsMs 2329343 Specdb::MsMs 2636332 Specdb::MsMs 2636333 Specdb::MsMs 2636334 FDB024098 4444375 5280826 C05803 27752 CPD-11655 BMDBP00405 2-methoxy-6-polyprenyl-1,4-benzoquinol methylase, mitochondrial Q0P5A2 COQ5 Enzyme BMDBP00877 Ubiquinone biosynthesis monooxygenase COQ6, mitochondrial Q2KIL4 COQ6 Enzyme