1.0 2010-04-08 22:12:49 UTC 2019-11-26 03:14:10 UTC FDB017077 3'-(gamma,gamma-Dimethylallyl)genistein Isolated from Cajanus cajan (pigeon pea). 3'-(gamma,gamma-Dimethylallyl)genistein is found in pigeon pea and pulses. 3'-(g,g-Dimethylallyl)genistein 3'-(γ,γ-dimethylallyl)genistein 3'-Isoprenylgenistein 3'-Prenyl-5,7,4'-trihydroxyisoflavone 3'-Prenylgenistein 5,7-Dihydroxy-3-[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]-4H-1-benzopyran-4-one, 9CI 5,7,4'-Trihydroxy-3'-prenylisoflavone Isowighteone C20H18O5 338.3539 338.115423686 5,7-dihydroxy-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-4H-chromen-4-one isowighteone 68436-47-5 CC(C)=CCC1=C(O)C=CC(=C1)C1=COC2=CC(O)=CC(O)=C2C1=O InChI=1S/C20H18O5/c1-11(2)3-4-13-7-12(5-6-16(13)22)15-10-25-18-9-14(21)8-17(23)19(18)20(15)24/h3,5-10,21-23H,4H2,1-2H3 SWDSVBNAMCDHTF-UHFFFAOYSA-N belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom. Isoflavones Organic compounds Phenylpropanoids and polyketides Isoflavonoids Isoflav-2-enes Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Benzene and substituted derivatives Chromones Heteroaromatic compounds Hydrocarbon derivatives Hydroxyisoflavonoids Organic oxides Organooxygen compounds Oxacyclic compounds Pyranones and derivatives Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Heteroaromatic compound Hydrocarbon derivative Hydroxyisoflavonoid Isoflavone Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Pyran Pyranone Vinylogous acid 7-hydroxyisoflavones Isoflavonoids logp 4.04 ALOGPS logs -4.54 ALOGPS solubility 9.70e-03 g/l ALOGPS melting_point Mp 171-172° logp 4.81 ChemAxon pka_strongest_acidic 6.61 ChemAxon pka_strongest_basic -5.2 ChemAxon iupac 5,7-dihydroxy-3-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]-4H-chromen-4-one ChemAxon average_mass 338.3539 ChemAxon mono_mass 338.115423686 ChemAxon smiles CC(C)=CCC1=C(O)C=CC(=C1)C1=COC2=CC(O)=CC(O)=C2C1=O ChemAxon formula C20H18O5 ChemAxon inchi InChI=1S/C20H18O5/c1-11(2)3-4-13-7-12(5-6-16(13)22)15-10-25-18-9-14(21)8-17(23)19(18)20(15)24/h3,5-10,21-23H,4H2,1-2H3 ChemAxon inchikey SWDSVBNAMCDHTF-UHFFFAOYSA-N ChemAxon polar_surface_area 86.99 ChemAxon refractivity 95.93 ChemAxon polarizability 36.16 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 53451 Specdb::MsMs 53452 Specdb::MsMs 53453 Specdb::MsMs 158859 Specdb::MsMs 158860 Specdb::MsMs 158861 Specdb::MsMs 2823500 Specdb::MsMs 2823501 Specdb::MsMs 2823502 Specdb::MsMs 2859431 Specdb::MsMs 2859432 Specdb::MsMs 2859433 Specdb::CMs 24872 Specdb::CMs 26935 Specdb::CMs 45590 Specdb::CMs 101914 Specdb::CMs 146065 HMDB37920 #<Reference:0x000055ce305f60f0> Pigeon pea Type 1 specific Cajanus cajan 3821 Pulses Unknown generic