1.0 2010-04-08 22:15:00 UTC 2025-11-19 02:31:22 UTC FDB020405 Dihydroroseoside Isolated from a Riesling wine. Dihydroroseoside is found in alcoholic beverages and fruits. Dihydroroseoside C19H32O8 388.4526 388.209718 4-hydroxy-3,3,5-trimethyl-4-[(1E)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-1-en-1-yl]cyclohexan-1-one 4-hydroxy-3,3,5-trimethyl-4-[(1E)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-1-en-1-yl]cyclohexan-1-one 142235-28-7 CC(OC1OC(CO)C(O)C(O)C1O)\C=C\C1(O)C(C)CC(=O)CC1(C)C InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+ QFTPTUOKFIIFJH-AATRIKPKSA-N belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Fatty acyl glycosides of mono- and disaccharides Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acyl glycosides Aliphatic heteromonocyclic compounds Acetals Alkyl glycosides Cyclic alcohols and derivatives Cyclic ketones Hexoses Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Sesquiterpenoids Tertiary alcohols Acetal Alcohol Aliphatic heteromonocyclic compound Alkyl glycoside Carbonyl group Cyclic alcohol Cyclic ketone Cyclofarsesane sesquiterpenoid Fatty acyl glycoside of mono- or disaccharide Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Ionone derivative Ketone Megastigmane sesquiterpenoid Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Sesquiterpenoid Tertiary alcohol logp -0.18 ALOGPS logs -1.94 ALOGPS solubility 4.49e+00 g/l ALOGPS logp -0.38 ChemAxon pka_strongest_acidic 12.2 ChemAxon pka_strongest_basic -3 ChemAxon iupac 4-hydroxy-3,3,5-trimethyl-4-[(1E)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-1-en-1-yl]cyclohexan-1-one ChemAxon average_mass 388.4526 ChemAxon mono_mass 388.209718 ChemAxon smiles CC(OC1OC(CO)C(O)C(O)C1O)\C=C\C1(O)C(C)CC(=O)CC1(C)C ChemAxon formula C19H32O8 ChemAxon inchi InChI=1S/C19H32O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-6,10-11,13-17,20,22-25H,7-9H2,1-4H3/b6-5+ ChemAxon inchikey QFTPTUOKFIIFJH-AATRIKPKSA-N ChemAxon polar_surface_area 136.68 ChemAxon refractivity 96.59 ChemAxon polarizability 40.9 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 8 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21379 Specdb::CMs 46863 Specdb::CMs 151710 Specdb::CMs 151712 Specdb::CMs 151714 Specdb::CMs 151716 Specdb::CMs 151718 Specdb::CMs 169283 Specdb::CMs 279857 Specdb::MsMs 313555 Specdb::MsMs 313556 Specdb::MsMs 313557 Specdb::MsMs 359068 Specdb::MsMs 359069 Specdb::MsMs 359070 Specdb::MsMs 452254 Specdb::MsMs 2722662 Specdb::MsMs 2722663 Specdb::MsMs 2722664 Specdb::MsMs 2959989 Specdb::MsMs 2959990 Specdb::MsMs 2959991 Specdb::NmrOneD 42322 Specdb::NmrOneD 42323 Specdb::NmrOneD 42324 Specdb::NmrOneD 42325 Specdb::NmrOneD 42326 Specdb::NmrOneD 42327 Specdb::NmrOneD 42328 Specdb::NmrOneD 42329 Specdb::NmrOneD 42330 Specdb::NmrOneD 42331 Specdb::NmrOneD 42332 Specdb::NmrOneD 42333 Specdb::NmrOneD 42334 Specdb::NmrOneD 42335 Specdb::NmrOneD 42336 Specdb::NmrOneD 42337 Specdb::NmrOneD 42338 Specdb::NmrOneD 42339 Specdb::NmrOneD 42340 Specdb::NmrOneD 42341 HMDB40614 #<Reference:0x000055ce3068d0b8> Alcoholic beverages Unknown generic Fruits Unknown generic