1.0 2010-04-08 22:13:02 UTC 2019-11-26 03:14:41 UTC FDB017337 Kievitol Isolated from Phaseolus lunatus (butter bean). Kievitol is found in pulses and lima bean. Kievitol C20H22O7 374.3845 374.136553058 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(4-hydroxy-3-methylbutyl)-3,4-dihydro-2H-1-benzopyran-4-one 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(4-hydroxy-3-methylbutyl)-2,3-dihydro-1-benzopyran-4-one 104363-14-6 CC(CO)CCC1=C2OCC(C(=O)C2=C(O)C=C1O)C1=C(O)C=C(O)C=C1 InChI=1S/C20H22O7/c1-10(8-21)2-4-13-16(24)7-17(25)18-19(26)14(9-27-20(13)18)12-5-3-11(22)6-15(12)23/h3,5-7,10,14,21-25H,2,4,8-9H2,1H3 AHXHRRAHHBWGJJ-UHFFFAOYSA-N belongs to the class of organic compounds known as 8-prenylated isoflavanones. These are isoflavanones featuring a C5-isoprenoid unit at the 8-position. 8-prenylated isoflavanones Organic compounds Phenylpropanoids and polyketides Isoflavonoids Isoflavans Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Aryl alkyl ketones Benzene and substituted derivatives Chromones Hydrocarbon derivatives Hydroxyisoflavonoids Isoflavanols Organic oxides Oxacyclic compounds Primary alcohols Resorcinols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 8-prenylated isoflavanone Alcohol Alkyl aryl ether Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Hydrocarbon derivative Hydroxyisoflavonoid Isoflavanol Ketone Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Primary alcohol Resorcinol Vinylogous acid logp 2.22 ALOGPS logs -3.80 ALOGPS solubility 5.88e-02 g/l ALOGPS logp 3.2 ChemAxon pka_strongest_acidic 8.15 ChemAxon pka_strongest_basic -2.6 ChemAxon iupac 3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-8-(4-hydroxy-3-methylbutyl)-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 374.3845 ChemAxon mono_mass 374.136553058 ChemAxon smiles CC(CO)CCC1=C2OCC(C(=O)C2=C(O)C=C1O)C1=C(O)C=C(O)C=C1 ChemAxon formula C20H22O7 ChemAxon inchi InChI=1S/C20H22O7/c1-10(8-21)2-4-13-16(24)7-17(25)18-19(26)14(9-27-20(13)18)12-5-3-11(22)6-15(12)23/h3,5-7,10,14,21-25H,2,4,8-9H2,1H3 ChemAxon inchikey AHXHRRAHHBWGJJ-UHFFFAOYSA-N ChemAxon polar_surface_area 127.45 ChemAxon refractivity 98.9 ChemAxon polarizability 38.18 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 7 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22407 Specdb::CMs 45686 Specdb::CMs 157314 Specdb::MsMs 71253 Specdb::MsMs 71254 Specdb::MsMs 71255 Specdb::MsMs 129888 Specdb::MsMs 129889 Specdb::MsMs 129890 Specdb::MsMs 2684694 Specdb::MsMs 2684695 Specdb::MsMs 2684696 Specdb::MsMs 3024534 Specdb::MsMs 3024535 Specdb::MsMs 3024536 HMDB38112 #<Reference:0x00007f093c0caf20> Lima bean Type 1 specific Phaseolus lunatus 3884 Pulses Unknown generic