1.0 2010-04-08 22:15:10 UTC 2019-11-26 03:19:15 UTC FDB020659 3-O-Methyluralenol Constituent of the leaves of Glycyrrhiza uralensis (Chinese licorice). 3-O-Methyluralenol is found in herbs and spices. 2-[3,4-Dihydroxy-5-(3-methyl-2-butenyl)phenyl]-5,7-dihydroxy-3-methoxy-4H-1-benzopyran-4-one 3-O-Methyluralenol 3',4',5,7-Tetrahydroxy-3-methoxy-5'-prenylflavone 5,7,3',4'-Tetrahydroxy-3-methoxy-5'-isoprenylflavone 5,7,3',4'-Tetrahydroxy-3-methoxy-5'-prenylflavone Uralenol-3-methylether C21H20O7 384.3793 384.120902994 2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-3-methoxy-4H-chromen-4-one 2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-3-methoxychromen-4-one 150853-98-8 COC1=C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC(O)=C(O)C(CC=C(C)C)=C1 InChI=1S/C21H20O7/c1-10(2)4-5-11-6-12(7-15(24)18(11)25)20-21(27-3)19(26)17-14(23)8-13(22)9-16(17)28-20/h4,6-9,22-25H,5H2,1-3H3 VCKYLOIMXUHPDA-UHFFFAOYSA-N belongs to the class of organic compounds known as 3'-prenylated flavones. These are flavones that features a C5-isoprenoid substituent at the 3'-position. 3'-prenylated flavones Organic compounds Phenylpropanoids and polyketides Flavonoids Flavones Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 3-O-methylated flavonoids 3-methoxychromones 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Alkyl aryl ethers Benzene and substituted derivatives Catechols Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Oxacyclic compounds Pyranones and derivatives Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid 3'-prenylated flavone 3-methoxychromone 3-methoxyflavonoid-skeleton 4'-hydroxyflavonoid 5-hydroxyflavonoid 7-hydroxyflavonoid Alkyl aryl ether Aromatic heteropolycyclic compound Benzenoid Benzopyran Catechol Chromone Ether Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Pyran Pyranone Vinylogous acid Flavones and Flavonols logp 3.71 ALOGPS logs -4.36 ALOGPS solubility 1.68e-02 g/l ALOGPS melting_point Mp 104-109° logp 4 ChemAxon pka_strongest_acidic 6.44 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac 2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5,7-dihydroxy-3-methoxy-4H-chromen-4-one ChemAxon average_mass 384.3793 ChemAxon mono_mass 384.120902994 ChemAxon smiles COC1=C(OC2=CC(O)=CC(O)=C2C1=O)C1=CC(O)=C(O)C(CC=C(C)C)=C1 ChemAxon formula C21H20O7 ChemAxon inchi InChI=1S/C21H20O7/c1-10(2)4-5-11-6-12(7-15(24)18(11)25)20-21(27-3)19(26)17-14(23)8-13(22)9-16(17)28-20/h4,6-9,22-25H,5H2,1-3H3 ChemAxon inchikey VCKYLOIMXUHPDA-UHFFFAOYSA-N ChemAxon polar_surface_area 116.45 ChemAxon refractivity 105.86 ChemAxon polarizability 40.1 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 7 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 12233 Specdb::CMs 46994 Specdb::CMs 168415 Specdb::MsMs 292960 Specdb::MsMs 292961 Specdb::MsMs 292962 Specdb::MsMs 333304 Specdb::MsMs 333305 Specdb::MsMs 333306 Specdb::MsMs 2278769 Specdb::MsMs 2278770 Specdb::MsMs 2278771 Specdb::MsMs 3089941 Specdb::MsMs 3089942 Specdb::MsMs 3089943 HMDB40837 #<Reference:0x000055ce30659bc8> Herbs and Spices Unknown generic