1.0 2010-04-08 22:12:45 UTC 2019-11-26 03:14:00 UTC FDB016968 Glucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadienoate Present in Riesling wine. Glucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadienoate is found in alcoholic beverages. (2E,6E,10x)-10,11-Dihydroxy-2,6-farnesadien-1-oic acid b-D-glucopyranosyl ester (2E,6E,10x)-10,11-Dihydroxy-2,6-farnesadien-1-oic acid glucosyl ester Glucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadien-1-oate Glucosyl (2E,6E,10x)-10,11-dihydroxy-2,6-farnesadienoate C21H36O9 432.5051 432.23593275 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,6E)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienoate 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,6E)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienoate 204927-92-4 C\C(CCC(O)C(C)(C)O)=C/CC\C(C)=C\C(=O)OC1OC(CO)C(O)C(O)C1O InChI=1S/C21H36O9/c1-12(8-9-15(23)21(3,4)28)6-5-7-13(2)10-16(24)30-20-19(27)18(26)17(25)14(11-22)29-20/h6,10,14-15,17-20,22-23,25-28H,5,7-9,11H2,1-4H3/b12-6+,13-10+ MSRVZJWXQUEINS-WAAHFECUSA-N belongs to the class of organic compounds known as terpene glycosides. These are prenol lipids containing a carbohydrate moiety glycosidically bound to a terpene backbone. Terpene glycosides Organic compounds Lipids and lipid-like molecules Prenol lipids Terpene glycosides Aliphatic heteromonocyclic compounds Acetals Alkyl glycosides Carbonyl compounds Enoate esters Fatty acid esters Fatty acyl glycosides of mono- and disaccharides Fatty alcohols Hexoses Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Sesquiterpenoids Tertiary alcohols Acetal Alcohol Aliphatic heteromonocyclic compound Alkyl glycoside Alpha,beta-unsaturated carboxylic ester Carbonyl group Carboxylic acid derivative Carboxylic acid ester Enoate ester Farsesane sesquiterpenoid Fatty acid ester Fatty acyl Fatty acyl glycoside Fatty acyl glycoside of mono- or disaccharide Fatty alcohol Hexose monosaccharide Hydrocarbon derivative Monocarboxylic acid or derivatives Monosaccharide Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Sesquiterpenoid Terpene glycoside Tertiary alcohol logp 0.45 ALOGPS logs -2.55 ALOGPS solubility 1.23e+00 g/l ALOGPS logp 0.31 ChemAxon pka_strongest_acidic 12.19 ChemAxon pka_strongest_basic -3 ChemAxon iupac 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2E,6E)-10,11-dihydroxy-3,7,11-trimethyldodeca-2,6-dienoate ChemAxon average_mass 432.5051 ChemAxon mono_mass 432.23593275 ChemAxon smiles C\C(CCC(O)C(C)(C)O)=C/CC\C(C)=C\C(=O)OC1OC(CO)C(O)C(O)C1O ChemAxon formula C21H36O9 ChemAxon inchi InChI=1S/C21H36O9/c1-12(8-9-15(23)21(3,4)28)6-5-7-13(2)10-16(24)30-20-19(27)18(26)17(25)14(11-22)29-20/h6,10,14-15,17-20,22-23,25-28H,5,7-9,11H2,1-4H3/b12-6+,13-10+ ChemAxon inchikey MSRVZJWXQUEINS-WAAHFECUSA-N ChemAxon polar_surface_area 156.91 ChemAxon refractivity 109.63 ChemAxon polarizability 46.83 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 8 ChemAxon donor_count 6 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23720 Specdb::CMs 45563 Specdb::CMs 132724 Specdb::CMs 140458 Specdb::MsMs 48309 Specdb::MsMs 48310 Specdb::MsMs 48311 Specdb::MsMs 113871 Specdb::MsMs 113872 Specdb::MsMs 113873 Specdb::MsMs 2274693 Specdb::MsMs 2274694 Specdb::MsMs 2274695 Specdb::MsMs 3090839 Specdb::MsMs 3090840 Specdb::MsMs 3090841 HMDB37823 #<Reference:0x000055ce332fb3e8> Alcoholic beverages Unknown generic