1.0 2010-04-08 22:13:38 UTC 2025-11-19 02:10:51 UTC FDB018320 Licopyranocoumarin Isolated from Glycyrrhiza species Licopyranocoumarin is found in herbs and spices. Licopyranocoumarin C21H20O7 384.3793 384.120902994 3-(2,4-dihydroxyphenyl)-8-(hydroxymethyl)-5-methoxy-8-methyl-2H,6H,7H,8H-pyrano[3,2-g]chromen-2-one licopyranocoumarin 117038-80-9 COC1=C2C=C(C(=O)OC2=CC2=C1CCC(C)(CO)O2)C1=C(O)C=C(O)C=C1 InChI=1S/C21H20O7/c1-21(10-22)6-5-13-18(28-21)9-17-15(19(13)26-2)8-14(20(25)27-17)12-4-3-11(23)7-16(12)24/h3-4,7-9,22-24H,5-6,10H2,1-2H3 MOBCUWLJOZHPQL-UHFFFAOYSA-N belongs to the class of organic compounds known as hydroxyisoflavonoids. These are organic compounds containing an isoflavonoid skeleton carrying one or more hydroxyl groups. Hydroxyisoflavonoids Organic compounds Phenylpropanoids and polyketides Isoflavonoids Hydroxyisoflavonoids Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Anisoles Benzene and substituted derivatives Heteroaromatic compounds Hydrocarbon derivatives Isoflav-3-enones Lactones Linear pyranocoumarins Organic oxides Oxacyclic compounds Primary alcohols Pyranochromenes Pyranones and derivatives Resorcinols 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromane Coumarin Ether Heteroaromatic compound Hydrocarbon derivative Hydroxyisoflavonoid Isoflav-3-enone skeleton Lactone Linear pyranocoumarin Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Primary alcohol Pyran Pyranochromene Pyranocoumarin Pyranone Resorcinol Other Flavonoids logp 2.60 ALOGPS logs -4.15 ALOGPS solubility 2.70e-02 g/l ALOGPS melting_point Mp 137° logp 2.66 ChemAxon pka_strongest_acidic 8.49 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 3-(2,4-dihydroxyphenyl)-8-(hydroxymethyl)-5-methoxy-8-methyl-2H,6H,7H,8H-pyrano[3,2-g]chromen-2-one ChemAxon average_mass 384.3793 ChemAxon mono_mass 384.120902994 ChemAxon smiles COC1=C2C=C(C(=O)OC2=CC2=C1CCC(C)(CO)O2)C1=C(O)C=C(O)C=C1 ChemAxon formula C21H20O7 ChemAxon inchi InChI=1S/C21H20O7/c1-21(10-22)6-5-13-18(28-21)9-17-15(19(13)26-2)8-14(20(25)27-17)12-4-3-11(23)7-16(12)24/h3-4,7-9,22-24H,5-6,10H2,1-2H3 ChemAxon inchikey MOBCUWLJOZHPQL-UHFFFAOYSA-N ChemAxon polar_surface_area 105.45 ChemAxon refractivity 101.4 ChemAxon polarizability 39.87 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 6 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11238 Specdb::CMs 46118 Specdb::CMs 165804 Specdb::MsMs 88860 Specdb::MsMs 88861 Specdb::MsMs 88862 Specdb::MsMs 151668 Specdb::MsMs 151669 Specdb::MsMs 151670 Specdb::MsMs 2778787 Specdb::MsMs 2778788 Specdb::MsMs 2778789 Specdb::MsMs 2904018 Specdb::MsMs 2904019 Specdb::MsMs 2904020 HMDB38874 #<Reference:0x000055ce32296318> Herbs and Spices Unknown generic