1.0 2010-04-08 22:14:57 UTC 2019-11-26 03:18:46 UTC FDB020330 (E)-Oxyresveratrol 3'-O-b-D-glucoside Isolated from Morus alba (white mulberry). (E)-Oxyresveratrol 3'-O-b-D-glucoside is found in fruits. (E)-1-(2,4-Dihydroxyphenyl)-2-(3,5-dihydroxyphenyl)ethylene 3'-O-b-D-glucopyranoside (E)-Oxyresveratrol 3'-O-b-D-glucopyranoside Oxyresveratrol 3'-glucoside Oxyresveratrol 3'-O-b-D-glucoside Oxyresveratrol 3'-O-beta-glucopyranoside Oxyresveratrol 3'-O-glucoside C20H22O9 406.3833 406.126382302 2-{3-[(Z)-2-(2,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol 2-{3-[(Z)-2-(2,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol 144525-40-6 OCC1OC(OC2=CC(\C=C/C3=C(O)C=C(O)C=C3)=CC(O)=C2)C(O)C(O)C1O InChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-14-6-10(5-13(23)7-14)1-2-11-3-4-12(22)8-15(11)24/h1-8,16-27H,9H2/b2-1- GGQVPULXXVQLRT-UPHRSURJSA-N belongs to the class of organic compounds known as stilbene glycosides. Stilbene glycosides are compounds structurally characterized by the presence of a carbohydrate moiety glycosidically linked to the stilbene skeleton. Stilbene glycosides Organic compounds Phenylpropanoids and polyketides Stilbenes Stilbene glycosides Aromatic heteromonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Acetals Hexoses Hydrocarbon derivatives O-glycosyl compounds Oxacyclic compounds Oxanes Phenol ethers Phenolic glycosides Phenoxy compounds Polyols Primary alcohols Resorcinols Secondary alcohols Styrenes 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Acetal Alcohol Aromatic heteromonocyclic compound Benzenoid Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenol ether Phenolic glycoside Phenoxy compound Polyol Primary alcohol Resorcinol Secondary alcohol Stilbene glycoside Styrene logp 0.40 ALOGPS logs -2.70 ALOGPS solubility 8.08e-01 g/l ALOGPS melting_point Mp 155-157° logp 0.83 ChemAxon pka_strongest_acidic 8.92 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-{3-[(Z)-2-(2,4-dihydroxyphenyl)ethenyl]-5-hydroxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 406.3833 ChemAxon mono_mass 406.126382302 ChemAxon smiles OCC1OC(OC2=CC(\C=C/C3=C(O)C=C(O)C=C3)=CC(O)=C2)C(O)C(O)C1O ChemAxon formula C20H22O9 ChemAxon inchi InChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-14-6-10(5-13(23)7-14)1-2-11-3-4-12(22)8-15(11)24/h1-8,16-27H,9H2/b2-1- ChemAxon inchikey GGQVPULXXVQLRT-UPHRSURJSA-N ChemAxon polar_surface_area 160.07 ChemAxon refractivity 101.58 ChemAxon polarizability 40.07 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 9 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25361 Specdb::CMs 46828 Specdb::CMs 153431 Specdb::CMs 153433 Specdb::CMs 153435 Specdb::CMs 153437 Specdb::CMs 153439 Specdb::CMs 153440 Specdb::CMs 155777 Specdb::CMs 279915 Specdb::MsMs 322144 Specdb::MsMs 322145 Specdb::MsMs 322146 Specdb::MsMs 369982 Specdb::MsMs 369983 Specdb::MsMs 369984 Specdb::MsMs 2278502 Specdb::MsMs 2278503 Specdb::MsMs 2278504 Specdb::MsMs 3087739 Specdb::MsMs 3087740 Specdb::MsMs 3087741 HMDB40555 #<Reference:0x000055ce31feae70> Fruits Unknown generic