1.0 2010-04-08 22:11:45 UTC 2019-11-26 03:11:22 UTC FDB015277 Rumexoside Constituent of the roots of Rumex patientia (patience dock). Rumexoside is found in herbs and spices. Rumexoside C20H22O10 422.3827 422.121296924 6-acetyl-5-hydroxy-7-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}naphthalene-2-carboxylic acid 6-acetyl-5-hydroxy-7-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}naphthalene-2-carboxylic acid CC(=O)C1=C(O)C2=C(OC3OC(CO)C(O)C(O)C3O)C=C(C=C2C=C1C)C(O)=O InChI=1S/C20H22O10/c1-7-3-9-4-10(19(27)28)5-11(14(9)16(24)13(7)8(2)22)29-20-18(26)17(25)15(23)12(6-21)30-20/h3-5,12,15,17-18,20-21,23-26H,6H2,1-2H3,(H,27,28) GPYNRGVKMWCYIE-UHFFFAOYSA-N belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Phenolic glycosides Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aromatic heteropolycyclic compounds 1-hydroxy-4-unsubstituted benzenoids Acetals Acetophenones Aryl alkyl ketones Carboxylic acids Hexoses Hydrocarbon derivatives Monocarboxylic acids and derivatives Naphthalenecarboxylic acids Naphthols and derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Vinylogous acids 1-hydroxy-4-unsubstituted benzenoid 1-naphthol 2-naphthalenecarboxylic acid 2-naphthalenecarboxylic acid or derivatives Acetal Acetophenone Alcohol Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Carboxylic acid Carboxylic acid derivative Hexose monosaccharide Hydrocarbon derivative Ketone Monocarboxylic acid or derivatives Monosaccharide Naphthalene O-glycosyl compound Organic oxide Organoheterocyclic compound Oxacycle Oxane Phenolic glycoside Polyol Primary alcohol Secondary alcohol Vinylogous acid logp 0.14 ALOGPS logs -2.26 ALOGPS solubility 2.30e+00 g/l ALOGPS logp 0.47 ChemAxon pka_strongest_acidic 3.74 ChemAxon pka_strongest_basic -3 ChemAxon iupac 6-acetyl-5-hydroxy-7-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}naphthalene-2-carboxylic acid ChemAxon average_mass 422.3827 ChemAxon mono_mass 422.121296924 ChemAxon smiles CC(=O)C1=C(O)C2=C(OC3OC(CO)C(O)C(O)C3O)C=C(C=C2C=C1C)C(O)=O ChemAxon formula C20H22O10 ChemAxon inchi InChI=1S/C20H22O10/c1-7-3-9-4-10(19(27)28)5-11(14(9)16(24)13(7)8(2)22)29-20-18(26)17(25)15(23)12(6-21)30-20/h3-5,12,15,17-18,20-21,23-26H,6H2,1-2H3,(H,27,28) ChemAxon inchikey GPYNRGVKMWCYIE-UHFFFAOYSA-N ChemAxon polar_surface_area 173.98 ChemAxon refractivity 101.31 ChemAxon polarizability 41.24 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 10 ChemAxon donor_count 6 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 19151 Specdb::CMs 44851 Specdb::CMs 133453 Specdb::CMs 141187 Specdb::MsMs 109431 Specdb::MsMs 109432 Specdb::MsMs 109433 Specdb::MsMs 176859 Specdb::MsMs 176860 Specdb::MsMs 176861 Specdb::MsMs 2742346 Specdb::MsMs 2742347 Specdb::MsMs 2742348 Specdb::MsMs 2939894 Specdb::MsMs 2939895 Specdb::MsMs 2939896 HMDB36398 #<Reference:0x000055ce30252cf0> Herbs and Spices Unknown generic