1.0 2010-04-08 22:13:31 UTC 2025-11-19 02:09:25 UTC FDB018137 1-Glucosyl gallate Isolated from various plants, e.g. Rheum officinale (Chinese rhubarb), Eucalyptus subspecies 1-Glucosyl gallate is found in tea and green vegetables. 1-Galloyl-glucose 1-Galloylglucose 1-Glucosyl gallate 1-O-(3,4,5-trihydroxybenzoyl)-beta-D-glucopyranose 1-O-Galloyl-b-D-glucopyranose 3,4,5-Trihydroxybenzoyl glucoside b-Glucogallin beta-D-Glucopyranose, 1-(3,4,5-trihydroxybenzoate) D-Glucose 1-(3,4,5-trihydroxybenzoate) C13H16O10 332.2601 332.074346732 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3,4,5-trihydroxybenzoate glucogallin 13405-60-2 OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O InChI=1S/C13H16O10/c14-3-7-9(18)10(19)11(20)13(22-7)23-12(21)4-1-5(15)8(17)6(16)2-4/h1-2,7,9-11,13-20H,3H2 GDVRUDXLQBVIKP-UHFFFAOYSA-N belongs to the class of organic compounds known as tannins. These are naturally occurring polyphenols which be categorized into four main classes: hydrolyzable tannin (based on ellagic acid or gallic acid), condensed tannins (made of oligomeric or polymeric proanthocyanidins), complex tannins (made of a catechin bound to a gallotannin or elagitannin), and phlorotannins (oligomers of phloroglucinol). Tannins Organic compounds Phenylpropanoids and polyketides Tannins Aromatic heteromonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Acetals Benzoyl derivatives Carboxylic acid esters Galloyl esters Hexoses Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Pyrogallols and derivatives Secondary alcohols m-Hydroxybenzoic acid esters p-Hydroxybenzoic acid alkyl esters 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Acetal Alcohol Aromatic heteromonocyclic compound Benzenetriol Benzenoid Benzoate ester Benzoic acid or derivatives Benzoyl Carboxylic acid derivative Carboxylic acid ester Gallic acid or derivatives Galloyl ester Hexose monosaccharide Hydrocarbon derivative M-hydroxybenzoic acid ester Monocarboxylic acid or derivatives Monocyclic benzene moiety Monosaccharide Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane P-hydroxybenzoic acid alkyl ester P-hydroxybenzoic acid ester Phenol Polyol Primary alcohol Pyrogallol derivative Secondary alcohol Tannin a hydrolyzable tannin logp -1.27 ALOGPS logs -1.18 ALOGPS solubility 2.21e+01 g/l ALOGPS melting_point Mp 205-206° logp -1.3 ChemAxon pka_strongest_acidic 8.08 ChemAxon pka_strongest_basic -3 ChemAxon iupac 3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3,4,5-trihydroxybenzoate ChemAxon average_mass 332.2601 ChemAxon mono_mass 332.074346732 ChemAxon smiles OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O ChemAxon formula C13H16O10 ChemAxon inchi InChI=1S/C13H16O10/c14-3-7-9(18)10(19)11(20)13(22-7)23-12(21)4-1-5(15)8(17)6(16)2-4/h1-2,7,9-11,13-20H,3H2 ChemAxon inchikey GDVRUDXLQBVIKP-UHFFFAOYSA-N ChemAxon polar_surface_area 177.14 ChemAxon refractivity 71.69 ChemAxon polarizability 30.69 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 9 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12922 Specdb::CMs 46011 Specdb::CMs 155852 Specdb::NmrOneD 28862 Specdb::NmrOneD 28863 Specdb::NmrOneD 28864 Specdb::NmrOneD 28865 Specdb::NmrOneD 28866 Specdb::NmrOneD 28867 Specdb::NmrOneD 28868 Specdb::NmrOneD 28869 Specdb::NmrOneD 28870 Specdb::NmrOneD 28871 Specdb::NmrOneD 28872 Specdb::NmrOneD 28873 Specdb::NmrOneD 28874 Specdb::NmrOneD 28875 Specdb::NmrOneD 28876 Specdb::NmrOneD 28877 Specdb::NmrOneD 28878 Specdb::NmrOneD 28879 Specdb::NmrOneD 28880 Specdb::NmrOneD 28881 Specdb::MsMs 66255 Specdb::MsMs 66256 Specdb::MsMs 66257 Specdb::MsMs 123777 Specdb::MsMs 123778 Specdb::MsMs 123779 Specdb::MsMs 2234200 Specdb::MsMs 2793608 Specdb::MsMs 2793609 Specdb::MsMs 2793610 Specdb::MsMs 2885063 Specdb::MsMs 2885064 Specdb::MsMs 2885065 HMDB38728 #<Reference:0x000055ce327930c8> Black tea Type 1 2.8 2.8 2.8 mg/100 g Green tea Type 1 2.8 2.8 2.8 mg/100 g Green vegetables Unknown generic Herbal tea Type 1 2.8 2.8 2.8 mg/100 g Red tea Type 1 2.8 2.8 2.8 mg/100 g Tea Type 1 specific Camellia sinensis 4442 2.8 2.8 2.8 mg/100 g