1.0 2010-04-08 22:14:57 UTC 2019-11-26 03:18:47 UTC FDB020337 Aromadendrin 4'-methyl ether 7-rhamnoside Constituent of the fruit of orange (Citrus sinensis). Aromadendrin 4'-methyl ether 7-rhamnoside is found in sweet orange and citrus. Aromadendrin 4'-methyl ether 7-rhamnoside Dihydrokaempferide 7-rhamnoside C22H24O10 448.42 448.136946988 3,5-dihydroxy-2-(4-methoxyphenyl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-4-one 3,5-dihydroxy-2-(4-methoxyphenyl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2,3-dihydro-1-benzopyran-4-one 114847-26-6 COC1=CC=C(C=C1)C1OC2=CC(OC3OC(C)C(O)C(O)C3O)=CC(O)=C2C(=O)C1O InChI=1S/C22H24O10/c1-9-16(24)18(26)20(28)22(30-9)31-12-7-13(23)15-14(8-12)32-21(19(27)17(15)25)10-3-5-11(29-2)6-4-10/h3-9,16,18-24,26-28H,1-2H3 KDOAIGQCYMINEB-UHFFFAOYSA-N belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Flavonoid-7-O-glycosides Organic compounds Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3-hydroxyflavonoids 4'-O-methylated flavonoids 5-hydroxyflavonoids Acetals Alkyl aryl ethers Anisoles Aryl alkyl ketones Chromones Flavanonols Hexoses Hydrocarbon derivatives Methoxybenzenes O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Phenoxy compounds Polyols Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3-hydroxyflavonoid 4p-methoxyflavonoid-skeleton 5-hydroxyflavonoid Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Flavan Flavanone Flavanonol Flavonoid-7-o-glycoside Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Hydroxyflavonoid Ketone Methoxybenzene Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol ether Phenolic glycoside Phenoxy compound Polyol Secondary alcohol Vinylogous acid logp 0.63 ALOGPS logs -2.41 ALOGPS solubility 1.74e+00 g/l ALOGPS melting_point Mp 270-272° logp 1.04 ChemAxon pka_strongest_acidic 9.71 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 3,5-dihydroxy-2-(4-methoxyphenyl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 448.42 ChemAxon mono_mass 448.136946988 ChemAxon smiles COC1=CC=C(C=C1)C1OC2=CC(OC3OC(C)C(O)C(O)C3O)=CC(O)=C2C(=O)C1O ChemAxon formula C22H24O10 ChemAxon inchi InChI=1S/C22H24O10/c1-9-16(24)18(26)20(28)22(30-9)31-12-7-13(23)15-14(8-12)32-21(19(27)17(15)25)10-3-5-11(29-2)6-4-10/h3-9,16,18-24,26-28H,1-2H3 ChemAxon inchikey KDOAIGQCYMINEB-UHFFFAOYSA-N ChemAxon polar_surface_area 155.14 ChemAxon refractivity 107.71 ChemAxon polarizability 44.95 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 10 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20543 Specdb::CMs 46834 Specdb::CMs 134942 Specdb::CMs 142676 Specdb::MsMs 311758 Specdb::MsMs 311759 Specdb::MsMs 311760 Specdb::MsMs 356839 Specdb::MsMs 356840 Specdb::MsMs 356841 Specdb::MsMs 2693498 Specdb::MsMs 2693499 Specdb::MsMs 2693500 Specdb::MsMs 2984777 Specdb::MsMs 2984778 Specdb::MsMs 2984779 HMDB40561 #<Reference:0x000055ce31a53408> Citrus Unknown generic Sweet orange Type 1 specific Citrus sinensis 2711