1.0 2010-04-08 22:09:28 UTC 2019-11-26 03:04:33 UTC FDB011094 Kanzonol Z Constituent of Glycyrrhiza glabra (licorice). Kanzonol Z is found in tea and herbs and spices. 3,4'-Dihydroxy-3'-prenyl-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone C25H26O5 406.4709 406.178023942 5-hydroxy-4-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-12,12-dimethyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8,13-tetraen-6-one 5-hydroxy-4-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-12,12-dimethyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8,13-tetraen-6-one CC(C)=CCC1=CC(=CC=C1O)C1OC2=C(C=CC3=C2C=CC(C)(C)O3)C(=O)C1O InChI=1S/C25H26O5/c1-14(2)5-6-15-13-16(7-9-19(15)26)23-22(28)21(27)18-8-10-20-17(24(18)29-23)11-12-25(3,4)30-20/h5,7-13,22-23,26,28H,6H2,1-4H3 IOXLCTZITMJUKD-UHFFFAOYSA-N belongs to the class of organic compounds known as 3'-prenylated flavanones. These are flavanones that features a C5-isoprenoid substituent at the 3'-position. 3'-prenylated flavanones Organic compounds Phenylpropanoids and polyketides Flavonoids Flavans Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 2,2-dimethyl-1-benzopyrans 3-hydroxyflavonoids 4'-hydroxyflavonoids Alkyl aryl ethers Aryl alkyl ketones Benzene and substituted derivatives Chromones Flavanonols Hydrocarbon derivatives Organic oxides Oxacyclic compounds Pyranochromenes Pyranoflavonoids Secondary alcohols 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 2,2-dimethyl-1-benzopyran 3'-prenylated flavanone 3-hydroxyflavonoid 4'-hydroxyflavonoid Alcohol Alkyl aryl ether Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Flavanone Flavanonol Hydrocarbon derivative Hydroxyflavonoid Ketone Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Pyranochromene Pyranoflavonoid Secondary alcohol logp 4.30 ALOGPS logs -4.80 ALOGPS solubility 6.46e-03 g/l ALOGPS melting_point Mp 141-145.5° logp 4.71 ChemAxon pka_strongest_acidic 9.27 ChemAxon pka_strongest_basic -4 ChemAxon iupac 5-hydroxy-4-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-12,12-dimethyl-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8,13-tetraen-6-one ChemAxon average_mass 406.4709 ChemAxon mono_mass 406.178023942 ChemAxon smiles CC(C)=CCC1=CC(=CC=C1O)C1OC2=C(C=CC3=C2C=CC(C)(C)O3)C(=O)C1O ChemAxon formula C25H26O5 ChemAxon inchi InChI=1S/C25H26O5/c1-14(2)5-6-15-13-16(7-9-19(15)26)23-22(28)21(27)18-8-10-20-17(24(18)29-23)11-12-25(3,4)30-20/h5,7-13,22-23,26,28H,6H2,1-4H3 ChemAxon inchikey IOXLCTZITMJUKD-UHFFFAOYSA-N ChemAxon polar_surface_area 75.99 ChemAxon refractivity 117.3 ChemAxon polarizability 45.12 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20641 Specdb::CMs 43097 Specdb::CMs 170860 Specdb::MsMs 44814 Specdb::MsMs 44815 Specdb::MsMs 44816 Specdb::MsMs 118290 Specdb::MsMs 118291 Specdb::MsMs 118292 Specdb::MsMs 2414278 Specdb::MsMs 2414279 Specdb::MsMs 2414280 Specdb::MsMs 2551280 Specdb::MsMs 2551281 Specdb::MsMs 2551282 HMDB33099 #<Reference:0x000055ce31f50c58> 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