1.0 2010-04-08 22:05:18 UTC 2025-11-18 22:36:12 UTC FDB002282 L-Linalool 3-glucoside Constituent of wine grape (Vitis vinifera). L-Linalool 3-glucoside is found in many foods, some of which are tea, common grape, fruits, and alcoholic beverages. (R)-3,7-Dimethyl-1,6-octadien-3-ol 3-O-b-D-glucopyranoside (R)-3,7-Dimethyl-1,6-octadien-3-ol 3-O-b-D-glucoside (R)-3,7-Dimethyl-1,6-octadien-3-ol O-b-D-glucopyranoside L-Linalool 3-glucoside L-Linalool 3-O-b-D-glucoside C16H28O6 316.3899 316.188588628 2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 99096-59-0 CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C=C InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3 FLXYFXDZJHWWGW-UHFFFAOYSA-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 Hexoses Hydrocarbon derivatives Monocyclic monoterpenoids O-glycosyl compounds Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Acetal Alcohol Aliphatic heteromonocyclic compound Alkyl glycoside Fatty acyl glycoside of mono- or disaccharide Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Monocyclic monoterpenoid Monosaccharide Monoterpenoid O-glycosyl compound Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol logp 0.44 ALOGPS logs -1.53 ALOGPS solubility 9.41e+00 g/l ALOGPS logp 0.88 ChemAxon pka_strongest_acidic 12.21 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 316.3899 ChemAxon mono_mass 316.188588628 ChemAxon smiles CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C=C ChemAxon formula C16H28O6 ChemAxon inchi InChI=1S/C16H28O6/c1-5-16(4,8-6-7-10(2)3)22-15-14(20)13(19)12(18)11(9-17)21-15/h5,7,11-15,17-20H,1,6,8-9H2,2-4H3 ChemAxon inchikey FLXYFXDZJHWWGW-UHFFFAOYSA-N ChemAxon polar_surface_area 99.38 ChemAxon refractivity 82.62 ChemAxon polarizability 34.47 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23732 Specdb::CMs 41922 Specdb::CMs 134563 Specdb::CMs 142297 Specdb::MsMs 59595 Specdb::MsMs 59596 Specdb::MsMs 59597 Specdb::MsMs 115761 Specdb::MsMs 115762 Specdb::MsMs 115763 Specdb::MsMs 2763319 Specdb::MsMs 2763320 Specdb::MsMs 2763321 Specdb::MsMs 2942230 Specdb::MsMs 2942231 Specdb::MsMs 2942232 Specdb::NmrOneD 161649 Specdb::NmrOneD 161650 Specdb::NmrOneD 161651 Specdb::NmrOneD 161652 Specdb::NmrOneD 161653 Specdb::NmrOneD 161654 Specdb::NmrOneD 161655 Specdb::NmrOneD 161656 Specdb::NmrOneD 161657 Specdb::NmrOneD 161658 Specdb::NmrOneD 161659 Specdb::NmrOneD 161660 Specdb::NmrOneD 161661 Specdb::NmrOneD 161662 Specdb::NmrOneD 161663 Specdb::NmrOneD 161664 Specdb::NmrOneD 161665 Specdb::NmrOneD 161666 Specdb::NmrOneD 161667 Specdb::NmrOneD 161668 HMDB0030418 Alcoholic beverages Unknown generic Black tea Type 1 Common grape Type 1 specific Vitis vinifera 29760 Fruits Unknown generic Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442