1.0 2010-04-08 22:11:44 UTC 2025-11-19 00:53:33 UTC FDB015255 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-glucoside Constituent of Rheum species 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-glucoside is found in green vegetables. 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-glucoside 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-O-b-D-glucopyranoside 7-Hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-carboxylic acid 7-O-b-D-glucoside C17H18O10 382.3188 382.089996796 2-methyl-4-oxo-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromene-5-carboxylic acid 2-methyl-4-oxo-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromene-5-carboxylic acid CC1=CC(=O)C2=C(C=C(OC3OC(CO)C(O)C(O)C3O)C=C2O1)C(O)=O InChI=1S/C17H18O10/c1-6-2-9(19)12-8(16(23)24)3-7(4-10(12)25-6)26-17-15(22)14(21)13(20)11(5-18)27-17/h2-4,11,13-15,17-18,20-22H,5H2,1H3,(H,23,24) YXPDWQIPHUQHKB-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 Acetals Benzenoids Carboxylic acids Chromones Heteroaromatic compounds Hexoses Hydrocarbon derivatives Monocarboxylic acids and derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Pyranones and derivatives Secondary alcohols 1-benzopyran Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Carboxylic acid Carboxylic acid derivative Chromone Heteroaromatic compound Hexose monosaccharide Hydrocarbon derivative Monocarboxylic acid or derivatives Monosaccharide O-glycosyl compound Organic oxide Organoheterocyclic compound Oxacycle Oxane Phenolic glycoside Polyol Primary alcohol Pyran Pyranone Secondary alcohol logp -0.89 ALOGPS logs -1.89 ALOGPS solubility 4.90e+00 g/l ALOGPS logp -1 ChemAxon pka_strongest_acidic 3.58 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-methyl-4-oxo-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromene-5-carboxylic acid ChemAxon average_mass 382.3188 ChemAxon mono_mass 382.089996796 ChemAxon smiles CC1=CC(=O)C2=C(C=C(OC3OC(CO)C(O)C(O)C3O)C=C2O1)C(O)=O ChemAxon formula C17H18O10 ChemAxon inchi InChI=1S/C17H18O10/c1-6-2-9(19)12-8(16(23)24)3-7(4-10(12)25-6)26-17-15(22)14(21)13(20)11(5-18)27-17/h2-4,11,13-15,17-18,20-22H,5H2,1H3,(H,23,24) ChemAxon inchikey YXPDWQIPHUQHKB-UHFFFAOYSA-N ChemAxon polar_surface_area 162.98 ChemAxon refractivity 88.49 ChemAxon polarizability 36.09 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 10 ChemAxon donor_count 5 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21691 Specdb::CMs 44841 Specdb::CMs 146677 Specdb::NmrOneD 135970 Specdb::NmrOneD 135971 Specdb::NmrOneD 135972 Specdb::NmrOneD 135973 Specdb::NmrOneD 135974 Specdb::NmrOneD 135975 Specdb::NmrOneD 135976 Specdb::NmrOneD 135977 Specdb::NmrOneD 135978 Specdb::NmrOneD 135979 Specdb::NmrOneD 135980 Specdb::NmrOneD 135981 Specdb::NmrOneD 135982 Specdb::NmrOneD 135983 Specdb::NmrOneD 135984 Specdb::NmrOneD 135985 Specdb::NmrOneD 135986 Specdb::NmrOneD 135987 Specdb::NmrOneD 135988 Specdb::NmrOneD 135989 Specdb::MsMs 91923 Specdb::MsMs 91924 Specdb::MsMs 91925 Specdb::MsMs 155418 Specdb::MsMs 155419 Specdb::MsMs 155420 Specdb::MsMs 2356659 Specdb::MsMs 2356660 Specdb::MsMs 2356661 Specdb::MsMs 2609456 Specdb::MsMs 2609457 Specdb::MsMs 2609458 HMDB36377 #<Reference:0x000055ce2f3d8238> Green vegetables Unknown generic