1.0 2010-04-08 22:13:59 UTC 2019-11-26 03:16:48 UTC FDB018858 Peumoside Isolated from Peumus boldus (boldo). Peumoside is found in fruits. Peumoside C27H30O15 594.5181 594.15847029 5-hydroxy-2-{4-hydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}-7-methoxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-4H-chromen-4-one 5-hydroxy-2-{4-hydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}-7-methoxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]chromen-4-one COC1=CC(O)=C2C(=O)C(OC3OCC(O)C(O)C3O)=C(OC2=C1)C1=CC(OC2OC(C)C(O)C(O)C2O)=C(O)C=C1 InChI=1S/C27H30O15/c1-9-18(31)21(34)23(36)27(39-9)41-15-5-10(3-4-12(15)28)24-25(42-26-22(35)19(32)14(30)8-38-26)20(33)17-13(29)6-11(37-2)7-16(17)40-24/h3-7,9,14,18-19,21-23,26-32,34-36H,8H2,1-2H3 LFJUOZMJVFOFOV-UHFFFAOYSA-N belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Flavonoid-3-O-glycosides Organic compounds Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-O-methylated flavonoids Acetals Alkyl aryl ethers Anisoles Chromones Flavones Heteroaromatic compounds Hydrocarbon derivatives Monosaccharides O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Phenoxy compounds Polyols Pyranones and derivatives Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 4'-hydroxyflavonoid 5-hydroxyflavonoid 7-methoxyflavonoid-skeleton Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Ether Flavone Flavonoid-3-o-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenol ether Phenolic glycoside Phenoxy compound Polyol Pyran Pyranone Secondary alcohol Vinylogous acid logp 0.17 ALOGPS logs -2.46 ALOGPS solubility 2.06e+00 g/l ALOGPS melting_point Mp 195-197° logp -0.59 ChemAxon pka_strongest_acidic 8.24 ChemAxon pka_strongest_basic -3.5 ChemAxon iupac 5-hydroxy-2-{4-hydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}-7-methoxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-4H-chromen-4-one ChemAxon average_mass 594.5181 ChemAxon mono_mass 594.15847029 ChemAxon smiles COC1=CC(O)=C2C(=O)C(OC3OCC(O)C(O)C3O)=C(OC2=C1)C1=CC(OC2OC(C)C(O)C(O)C2O)=C(O)C=C1 ChemAxon formula C27H30O15 ChemAxon inchi InChI=1S/C27H30O15/c1-9-18(31)21(34)23(36)27(39-9)41-15-5-10(3-4-12(15)28)24-25(42-26-22(35)19(32)14(30)8-38-26)20(33)17-13(29)6-11(37-2)7-16(17)40-24/h3-7,9,14,18-19,21-23,26-32,34-36H,8H2,1-2H3 ChemAxon inchikey LFJUOZMJVFOFOV-UHFFFAOYSA-N ChemAxon polar_surface_area 234.29 ChemAxon refractivity 138.4 ChemAxon polarizability 57.5 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 15 ChemAxon donor_count 8 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25492 Specdb::CMs 46353 Specdb::CMs 282981 Specdb::CMs 436312 Specdb::CMs 436313 Specdb::CMs 436314 Specdb::CMs 436315 Specdb::CMs 436316 Specdb::CMs 436317 Specdb::CMs 436318 Specdb::CMs 436319 Specdb::CMs 436320 Specdb::CMs 436321 Specdb::CMs 436322 Specdb::CMs 436323 Specdb::CMs 436324 Specdb::CMs 436325 Specdb::CMs 436326 Specdb::CMs 436327 Specdb::CMs 436328 Specdb::CMs 436329 Specdb::CMs 436330 Specdb::CMs 436331 Specdb::CMs 436332 Specdb::CMs 436333 Specdb::MsMs 102528 Specdb::MsMs 102529 Specdb::MsMs 102530 Specdb::MsMs 168366 Specdb::MsMs 168367 Specdb::MsMs 168368 Specdb::MsMs 2414260 Specdb::MsMs 2414261 Specdb::MsMs 2414262 Specdb::MsMs 2551268 Specdb::MsMs 2551269 Specdb::MsMs 2551270 Specdb::NmrOneD 32182 Specdb::NmrOneD 32183 Specdb::NmrOneD 32184 Specdb::NmrOneD 32185 Specdb::NmrOneD 32186 Specdb::NmrOneD 32187 Specdb::NmrOneD 32188 Specdb::NmrOneD 32189 Specdb::NmrOneD 32190 Specdb::NmrOneD 32191 Specdb::NmrOneD 32192 Specdb::NmrOneD 32193 Specdb::NmrOneD 32194 Specdb::NmrOneD 32195 Specdb::NmrOneD 32196 Specdb::NmrOneD 32197 Specdb::NmrOneD 32198 Specdb::NmrOneD 32199 Specdb::NmrOneD 32200 Specdb::NmrOneD 32201 HMDB39308 #<Reference:0x000055ce32fc1830> Fruits Unknown generic