1.0 2010-04-08 22:10:08 UTC 2019-11-26 03:06:40 UTC FDB012385 (E)-4'-Methylresveratrol 3-glucoside Constituent of rhubarb (Rheum rhaponticum) root. (E)-4'-Methylresveratrol 3-glucoside is found in green vegetables. (E)-4'-Methylresveratrol 3-glucoside (E)-4'-Methylresveratrol 3-O-b-D-glucopyranoside C21H24O8 404.4105 404.147117744 2-{3-hydroxy-5-[(Z)-2-(4-methoxyphenyl)ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol 2-{3-hydroxy-5-[(Z)-2-(4-methoxyphenyl)ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol 617-45-8 COC1=CC=C(\C=C/C2=CC(O)=CC(OC3OC(CO)C(O)C(O)C3O)=C2)C=C1 InChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2- MFMQRDLLSRLUJY-IHWYPQMZSA-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 Alkyl aryl ethers Anisoles Hexoses Hydrocarbon derivatives Methoxybenzenes O-glycosyl compounds Oxacyclic compounds Oxanes Phenolic glycosides Phenoxy compounds Polyols Primary alcohols Secondary alcohols Styrenes 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteromonocyclic compound Benzenoid Ether Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Methoxybenzene 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 Secondary alcohol Stilbene glycoside Styrene logp 1.11 ALOGPS logs -2.85 ALOGPS solubility 5.72e-01 g/l ALOGPS melting_point Mp 226-228° logp 1.28 ChemAxon pka_strongest_acidic 9.33 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-{3-hydroxy-5-[(Z)-2-(4-methoxyphenyl)ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 404.4105 ChemAxon mono_mass 404.147117744 ChemAxon smiles COC1=CC=C(\C=C/C2=CC(O)=CC(OC3OC(CO)C(O)C(O)C3O)=C2)C=C1 ChemAxon formula C21H24O8 ChemAxon inchi InChI=1S/C21H24O8/c1-27-15-6-4-12(5-7-15)2-3-13-8-14(23)10-16(9-13)28-21-20(26)19(25)18(24)17(11-22)29-21/h2-10,17-26H,11H2,1H3/b3-2- ChemAxon inchikey MFMQRDLLSRLUJY-IHWYPQMZSA-N ChemAxon polar_surface_area 128.84 ChemAxon refractivity 104.08 ChemAxon polarizability 41.39 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 8 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 73998 Specdb::MsMs 73999 Specdb::MsMs 74000 Specdb::MsMs 133269 Specdb::MsMs 133270 Specdb::MsMs 133271 Specdb::MsMs 2339010 Specdb::MsMs 2339011 Specdb::MsMs 2339012 Specdb::MsMs 2624096 Specdb::MsMs 2624097 Specdb::MsMs 2624098 Specdb::CMs 20729 Specdb::CMs 43720 Specdb::CMs 161654 HMDB34117 #<Reference:0x000055ce31dc29e0> Green vegetables Unknown generic