1.0 2010-04-08 22:11:09 UTC 2019-11-26 03:09:40 UTC FDB014219 Glycyrrhizaflavonol A Constituent of licorice (Glycyrrhiza species). Glycyrrhizaflavonol A is found in tea and herbs and spices. 1-Dimethylamino-2-methyl-2-aminopropane 2-(3,4-Dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-3,5,7-trihydroxy-4H-1-benzopyran-4-one Glycyrrhiza flavonol A C20H18O7 370.3527 370.10525293 3,5,7-trihydroxy-2-(3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-4H-chromen-4-one glycyrrhiza flavonol A 197304-01-1 CC1(C)OC2=C(CC1O)C=C(C=C2)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1 InChI=1S/C20H18O7/c1-20(2)15(23)6-10-5-9(3-4-13(10)27-20)19-18(25)17(24)16-12(22)7-11(21)8-14(16)26-19/h3-5,7-8,15,21-23,25H,6H2,1-2H3 UFWHTSBKDGUFOX-UHFFFAOYSA-N belongs to the class of organic compounds known as 3'-prenylated flavones. These are flavones that features a C5-isoprenoid substituent at the 3'-position. 3'-prenylated flavones Organic compounds Phenylpropanoids and polyketides Flavonoids Flavones Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 2,2-dimethyl-1-benzopyrans 3-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Alkyl aryl ethers Chromones Flavonols Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Oxacyclic compounds Polyols Pyranoflavonoids Pyranones and derivatives Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 2,2-dimethyl-1-benzopyran 3'-prenylated flavone 3-hydroxyflavone 3-hydroxyflavonoid 5-hydroxyflavonoid 7-hydroxyflavonoid Alcohol Alkyl aryl ether Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromane Chromone Ether Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Polyol Pyran Pyranoflavonoid Pyranone Secondary alcohol Vinylogous acid Flavones and Flavonols logp 2.62 ALOGPS logs -4.02 ALOGPS solubility 3.55e-02 g/l ALOGPS melting_point Mp 163° logp 2.71 ChemAxon pka_strongest_acidic 6.45 ChemAxon pka_strongest_basic -3.3 ChemAxon iupac 3,5,7-trihydroxy-2-(3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)-4H-chromen-4-one ChemAxon average_mass 370.3527 ChemAxon mono_mass 370.10525293 ChemAxon smiles CC1(C)OC2=C(CC1O)C=C(C=C2)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1 ChemAxon formula C20H18O7 ChemAxon inchi InChI=1S/C20H18O7/c1-20(2)15(23)6-10-5-9(3-4-13(10)27-20)19-18(25)17(24)16-12(22)7-11(21)8-14(16)26-19/h3-5,7-8,15,21-23,25H,6H2,1-2H3 ChemAxon inchikey UFWHTSBKDGUFOX-UHFFFAOYSA-N ChemAxon polar_surface_area 116.45 ChemAxon refractivity 97.69 ChemAxon polarizability 38.01 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 7 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25048 Specdb::CMs 44430 Specdb::CMs 152211 Specdb::MsMs 12914 Specdb::MsMs 12915 Specdb::MsMs 12916 Specdb::MsMs 19586 Specdb::MsMs 19587 Specdb::MsMs 19588 Specdb::MsMs 2426281 Specdb::MsMs 2426282 Specdb::MsMs 2426283 Specdb::MsMs 2509570 Specdb::MsMs 2509571 Specdb::MsMs 2509572 HMDB35527 #<Reference:0x000055ce327eac60> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Herbs and Spices Unknown generic Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442