1.0 2010-04-08 22:11:31 UTC 2018-05-29 01:15:23 UTC FDB014886 Ubiquinone 6 Isolated from bakers' yeast (Saccharomyces cerevisiae) (all-e)-2-(3,7,11,15,19,23-Hexamethyl-2,6,10,14,18,22-tetracosahexaenyl)-5,6-dimethoxy-3-methyl-2,5-cyclohexadiene-1,4-dione 2,3-Dimethoxy-5-methyl-6-hexaprenyl-1,4-benzoquinone Coenzyme Q6 Coenzyme Qq6 coenzyme-Q6 CoQ-6 CoQ6 Ubiquinone 30 Ubiquinone 6 Ubiquinone Q6 Ubiquinone-30 UBIQUINONE-6 ubiquinone(30) ubiquinone(6) C39H58O4 590.8754 590.433510344 2-(3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione 2-(3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione 1065-31-2 COC1=C(OC)C(=O)C(CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)=C(C)C1=O InChI=1S/C39H58O4/c1-28(2)16-11-17-29(3)18-12-19-30(4)20-13-21-31(5)22-14-23-32(6)24-15-25-33(7)26-27-35-34(8)36(40)38(42-9)39(43-10)37(35)41/h16,18,20,22,24,26H,11-15,17,19,21,23,25,27H2,1-10H3 GXNFPEOUKFOTKY-UHFFFAOYSA-N belongs to the class of organic compounds known as ubiquinones. These are coenzyme Q derivatives containing a 5, 6-dimethoxy-3-methyl(1,4-benzoquinone) moiety to which an isoprenyl group is attached at ring position 2(or 6). Ubiquinones Organic compounds Lipids and lipid-like molecules Prenol lipids Quinone and hydroquinone lipids Aliphatic homomonocyclic compounds Hydrocarbon derivatives Organic oxides P-benzoquinones Polyprenylbenzoquinones 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 Ubiquinone skeleton Vinylogous ester a ubiquinone Liquid logp 8.41 ALOGPS logs -6.26 ALOGPS solubility 3.25e-04 g/l ALOGPS melting_point Mp 19-20° (16°) logp 10.52 ChemAxon pka_strongest_basic -4.7 ChemAxon iupac 2-(3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl)-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione ChemAxon average_mass 590.8754 ChemAxon mono_mass 590.433510344 ChemAxon smiles COC1=C(OC)C(=O)C(CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C)=C(C)C1=O ChemAxon formula C39H58O4 ChemAxon inchi InChI=1S/C39H58O4/c1-28(2)16-11-17-29(3)18-12-19-30(4)20-13-21-31(5)22-14-23-32(6)24-15-25-33(7)26-27-35-34(8)36(40)38(42-9)39(43-10)37(35)41/h16,18,20,22,24,26H,11-15,17,19,21,23,25,27H2,1-10H3 ChemAxon inchikey GXNFPEOUKFOTKY-UHFFFAOYSA-N ChemAxon polar_surface_area 52.6 ChemAxon refractivity 191.39 ChemAxon polarizability 73.45 ChemAxon rotatable_bond_count 19 ChemAxon acceptor_count 4 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12043 Specdb::MsMs 11561 Specdb::MsMs 11562 Specdb::MsMs 11563 Specdb::MsMs 18233 Specdb::MsMs 18234 Specdb::MsMs 18235 Specdb::MsMs 23759 Specdb::MsMs 23760 Specdb::MsMs 23761 Specdb::MsMs 30557 Specdb::MsMs 30558 Specdb::MsMs 30559 Specdb::MsMs 2387390 Specdb::MsMs 2387391 Specdb::MsMs 2387392 Specdb::MsMs 2578155 Specdb::MsMs 2578156 Specdb::MsMs 2578157 Specdb::NmrOneD 345988 Specdb::NmrOneD 345989 Specdb::NmrOneD 345990 Specdb::NmrOneD 345991 Specdb::NmrOneD 345992 Specdb::NmrOneD 345993 Specdb::NmrOneD 345994 Specdb::NmrOneD 345995 Specdb::NmrOneD 345996 Specdb::NmrOneD 345997 Specdb::NmrOneD 345998 Specdb::NmrOneD 345999 Specdb::NmrOneD 346000 Specdb::NmrOneD 346001 Specdb::NmrOneD 346002 Specdb::NmrOneD 346003 Specdb::NmrOneD 346004 Specdb::NmrOneD 346005 Specdb::NmrOneD 346006 Specdb::NmrOneD 346007 HMDB36062 52971 #<Reference:0x000055ce2f37f0e8>