1.0 2010-04-08 22:14:57 UTC 2025-11-19 02:29:51 UTC FDB020338 Mauritianin Constituent of seeds of quinoa (Chenopodium quinoa). Mauritianin is found in cereals and cereal products and quinoa. 3-O-[2,6-di-O-alpha-L-rhamnopyranosyl-beta-D-galactopyranosyl] kaempferol Kaempferol 3-(2G-rhamnosylrobinobioside) Mauritianin C33H40O19 740.6593 740.216379098 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one 109008-28-8 CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3 WRXVPTMENPZUIZ-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-hydroxyflavonoids Acetals Benzene and substituted derivatives Chromones Flavones Heteroaromatic compounds Hydrocarbon derivatives O-glycosyl compounds Oligosaccharides Organic oxides Oxacyclic compounds Oxanes 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-hydroxyflavonoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Flavone Flavonoid-3-o-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety O-glycosyl compound Oligosaccharide Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Polyol Pyran Pyranone Secondary alcohol Vinylogous acid logp -0.10 ALOGPS logs -2.00 ALOGPS solubility 7.42e+00 g/l ALOGPS melting_point Mp 202-204° logp -1.3 ChemAxon pka_strongest_acidic 6.43 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one ChemAxon average_mass 740.6593 ChemAxon mono_mass 740.216379098 ChemAxon smiles CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O ChemAxon formula C33H40O19 ChemAxon inchi InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(47-10)46-9-17-21(39)25(43)30(52-32-27(45)24(42)20(38)11(2)48-32)33(50-17)51-29-22(40)18-15(36)7-14(35)8-16(18)49-28(29)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3 ChemAxon inchikey WRXVPTMENPZUIZ-UHFFFAOYSA-N ChemAxon polar_surface_area 304.21 ChemAxon refractivity 169.03 ChemAxon polarizability 71.21 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 19 ChemAxon donor_count 11 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 769672 Specdb::CMs 769673 Specdb::CMs 769674 Specdb::CMs 769675 Specdb::CMs 769676 Specdb::CMs 769677 Specdb::CMs 769678 Specdb::CMs 769679 Specdb::CMs 769680 Specdb::CMs 769681 Specdb::CMs 769682 Specdb::CMs 769683 Specdb::CMs 769684 Specdb::CMs 769685 Specdb::CMs 769686 Specdb::CMs 769687 Specdb::CMs 769688 Specdb::CMs 769689 Specdb::CMs 769690 Specdb::CMs 769691 Specdb::CMs 769692 Specdb::CMs 769693 Specdb::CMs 769694 Specdb::CMs 769695 Specdb::CMs 769696 Specdb::MsMs 10709 Specdb::MsMs 10710 Specdb::MsMs 10711 Specdb::MsMs 12731 Specdb::MsMs 12732 Specdb::MsMs 12733 Specdb::MsMs 17381 Specdb::MsMs 17382 Specdb::MsMs 17383 Specdb::MsMs 19403 Specdb::MsMs 19404 Specdb::MsMs 19405 Specdb::MsMs 440533 Specdb::MsMs 450191 Specdb::MsMs 450192 Specdb::MsMs 450193 Specdb::MsMs 450194 Specdb::MsMs 452115 Specdb::MsMs 2229086 Specdb::MsMs 2230385 Specdb::MsMs 2231377 Specdb::MsMs 2232810 Specdb::MsMs 2233824 Specdb::MsMs 2235142 Specdb::MsMs 2278886 Specdb::NmrOneD 41942 Specdb::NmrOneD 41943 Specdb::NmrOneD 41944 Specdb::NmrOneD 41945 Specdb::NmrOneD 41946 Specdb::NmrOneD 41947 Specdb::NmrOneD 41948 Specdb::NmrOneD 41949 Specdb::NmrOneD 41950 Specdb::NmrOneD 41951 Specdb::NmrOneD 41952 Specdb::NmrOneD 41953 Specdb::NmrOneD 41954 Specdb::NmrOneD 41955 Specdb::NmrOneD 41956 Specdb::NmrOneD 41957 Specdb::NmrOneD 41958 Specdb::NmrOneD 41959 Specdb::NmrOneD 41960 Specdb::NmrOneD 41961 HMDB40562 #<Reference:0x000055ce32af55e0> Breakfast cereal Type 2 specific Cereals and cereal products Unknown generic Quinoa Type 1 specific Chenopodium quinoa 63459