1.0 2010-04-08 22:12:37 UTC 2019-11-26 03:13:41 UTC FDB016727 Pteleine Alkaloid tentatively identified in cells of Ruta graveolens (rue) grown in continuous light in liq. medium. Pteleine is found in herbs and spices. 4,6-Dimethoxy-furo(2,3-b)quinoline 4,6-Dimethoxyfuro[2,3-b]quinoline, 9CI 6-Methoxy dictamine 6-Methoxydictamnine Cyclocostunolide Furo(2,3-b)quinoline, 4,6-dimethoxy- Ptelein Pteleine C13H11NO3 229.2313 229.073893223 4,6-dimethoxyfuro[2,3-b]quinoline 4,6-dimethoxyfuro[2,3-b]quinoline 2221-41-2 COC1=CC2=C(C=C1)N=C1OC=CC1=C2OC InChI=1S/C13H11NO3/c1-15-8-3-4-11-10(7-8)12(16-2)9-5-6-17-13(9)14-11/h3-7H,1-2H3 ALLQMEDAYDKMIO-UHFFFAOYSA-N belongs to the class of organic compounds known as furanoquinolines. Furanoquinolines are compounds containing a furan ring fused to a quinoline. Furanoquinolines Organic compounds Organoheterocyclic compounds Quinolines and derivatives Furanoquinolines Aromatic heteropolycyclic compounds Alkyl aryl ethers Anisoles Azacyclic compounds Furans Furopyridines Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Pyridines and derivatives Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Azacycle Benzenoid Ether Furan Furanoquinoline Furopyridine Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Pyridine logp 3.08 ALOGPS logs -3.20 ALOGPS solubility 1.44e-01 g/l ALOGPS melting_point Mp 134-135° logp 2.34 ChemAxon pka_strongest_basic 3.06 ChemAxon iupac 4,6-dimethoxyfuro[2,3-b]quinoline ChemAxon average_mass 229.2313 ChemAxon mono_mass 229.073893223 ChemAxon smiles COC1=CC2=C(C=C1)N=C1OC=CC1=C2OC ChemAxon formula C13H11NO3 ChemAxon inchi InChI=1S/C13H11NO3/c1-15-8-3-4-11-10(7-8)12(16-2)9-5-6-17-13(9)14-11/h3-7H,1-2H3 ChemAxon inchikey ALLQMEDAYDKMIO-UHFFFAOYSA-N ChemAxon polar_surface_area 44.49 ChemAxon refractivity 61.7 ChemAxon polarizability 23.51 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20764 Specdb::CMs 133811 Specdb::CMs 141545 Specdb::MsMs 72144 Specdb::MsMs 72145 Specdb::MsMs 72146 Specdb::MsMs 130971 Specdb::MsMs 130972 Specdb::MsMs 130973 Specdb::MsMs 452132 Specdb::MsMs 2797520 Specdb::MsMs 2797521 Specdb::MsMs 2797522 Specdb::MsMs 2881949 Specdb::MsMs 2881950 Specdb::MsMs 2881951 HMDB37614 #<Reference:0x000055ce32c77800> Herbs and Spices Unknown generic