1.0 2010-04-08 22:10:11 UTC 2019-11-26 03:06:52 UTC FDB012476 Licoricidin Constituent of Glycyrrhiza glabra (licorice) and Glycyrrhiza uralensis (Chinese licorice). Licoricidin is found in tea and herbs and spices. 2',4',7-Trihydroxy-5-methoxy-3',6-diprenylisoflavan 5,2',4'-Trihydroxy-7-methoxy-6,3'-diprenylisoflavan Licoricidin C26H32O5 424.5293 424.224974134 4-[7-hydroxy-5-methoxy-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol 4-[7-hydroxy-5-methoxy-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol 30508-27-1 COC1=C(CC=C(C)C)C(O)=CC2=C1CC(CO2)C1=C(O)C(CC=C(C)C)=C(O)C=C1 InChI=1S/C26H32O5/c1-15(2)6-8-19-22(27)11-10-18(25(19)29)17-12-21-24(31-14-17)13-23(28)20(26(21)30-5)9-7-16(3)4/h6-7,10-11,13,17,27-29H,8-9,12,14H2,1-5H3 GBRZTUJCDFSIHM-UHFFFAOYSA-N belongs to the class of organic compounds known as 5-o-methylated isoflavonoids. These are isoflavonoids with methoxy groups attached to the C5 atom of the isoflavonoid backbone. Isoflavonoids are natural products derived from 3-phenylchromen-4-one. 5-O-methylated isoflavonoids Organic compounds Phenylpropanoids and polyketides Isoflavonoids O-methylated isoflavonoids Aromatic heteropolycyclic compounds 1-benzopyrans 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Anisoles Benzene and substituted derivatives Hydrocarbon derivatives Hydroxyisoflavonoids Isoflavanols Oxacyclic compounds Resorcinols 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 5-methoxyisoflavonoid-skeleton Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromane Ether Hydrocarbon derivative Hydroxyisoflavonoid Isoflavan Isoflavanol Monocyclic benzene moiety Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Resorcinol logp 4.85 ALOGPS logs -5.20 ALOGPS solubility 2.70e-03 g/l ALOGPS melting_point Mp 154-156° logp 6.19 ChemAxon pka_strongest_acidic 9.14 ChemAxon pka_strongest_basic -4.6 ChemAxon iupac 4-[7-hydroxy-5-methoxy-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-3-yl]-2-(3-methylbut-2-en-1-yl)benzene-1,3-diol ChemAxon average_mass 424.5293 ChemAxon mono_mass 424.224974134 ChemAxon smiles COC1=C(CC=C(C)C)C(O)=CC2=C1CC(CO2)C1=C(O)C(CC=C(C)C)=C(O)C=C1 ChemAxon formula C26H32O5 ChemAxon inchi InChI=1S/C26H32O5/c1-15(2)6-8-19-22(27)11-10-18(25(19)29)17-12-21-24(31-14-17)13-23(28)20(26(21)30-5)9-7-16(3)4/h6-7,10-11,13,17,27-29H,8-9,12,14H2,1-5H3 ChemAxon inchikey GBRZTUJCDFSIHM-UHFFFAOYSA-N ChemAxon polar_surface_area 79.15 ChemAxon refractivity 125.89 ChemAxon polarizability 48.3 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16432 Specdb::CMs 43749 Specdb::CMs 156400 Specdb::MsMs 10424 Specdb::MsMs 10425 Specdb::MsMs 10426 Specdb::MsMs 11456 Specdb::MsMs 11457 Specdb::MsMs 11458 Specdb::MsMs 17096 Specdb::MsMs 17097 Specdb::MsMs 17098 Specdb::MsMs 18128 Specdb::MsMs 18129 Specdb::MsMs 18130 Specdb::MsMs 2703749 Specdb::MsMs 2703750 Specdb::MsMs 2703751 Specdb::MsMs 3001684 Specdb::MsMs 3001685 Specdb::MsMs 3001686 HMDB34183 #<Reference:0x000055ce31840508> 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