1.0 2010-04-08 22:15:23 UTC 2019-11-26 03:19:41 UTC FDB020965 Furoparadine Alkaloid from roots of Citrus paradisi (grapefruit). Furoparadine is found in citrus. C17H13NO5 311.2888 311.079372531 5,9-dihydroxy-10-methoxy-11-methyl-6H,11H-furo[2,3-c]acridin-6-one 5,9-dihydroxy-10-methoxy-11-methylfuro[2,3-c]acridin-6-one 161161-72-4 COC1=C(O)C=CC2=C1N(C)C1=C(C(O)=CC3=C1C=CO3)C2=O InChI=1S/C17H13NO5/c1-18-14-8-5-6-23-12(8)7-11(20)13(14)16(21)9-3-4-10(19)17(22-2)15(9)18/h3-7,19-20H,1-2H3 YVQYEEOGMKSXAW-UHFFFAOYSA-N belongs to the class of organic compounds known as acridones. These are acridines containing a ketone group attached to the C9 carbon atom of the acridine moiety. Acridones Organic compounds Organoheterocyclic compounds Quinolines and derivatives Benzoquinolines Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Anisoles Azacyclic compounds Benzofurans Furans Heteroaromatic compounds Hydrocarbon derivatives Hydroquinolines Hydroquinolones Organic oxides Organonitrogen compounds Organopnictogen compounds Oxacyclic compounds Pyridines and derivatives Vinylogous acids Vinylogous amides 1-hydroxy-2-unsubstituted benzenoid Acridone Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Azacycle Benzenoid Benzofuran Dihydroquinoline Dihydroquinolone Ether Furan Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Pyridine Vinylogous acid Vinylogous amide logp 2.96 ALOGPS logs -2.67 ALOGPS solubility 6.71e-01 g/l ALOGPS logp 3.17 ChemAxon pka_strongest_acidic 8.38 ChemAxon pka_strongest_basic -2.3 ChemAxon iupac 5,9-dihydroxy-10-methoxy-11-methyl-6H,11H-furo[2,3-c]acridin-6-one ChemAxon average_mass 311.2888 ChemAxon mono_mass 311.079372531 ChemAxon smiles COC1=C(O)C=CC2=C1N(C)C1=C(C(O)=CC3=C1C=CO3)C2=O ChemAxon formula C17H13NO5 ChemAxon inchi InChI=1S/C17H13NO5/c1-18-14-8-5-6-23-12(8)7-11(20)13(14)16(21)9-3-4-10(19)17(22-2)15(9)18/h3-7,19-20H,1-2H3 ChemAxon inchikey YVQYEEOGMKSXAW-UHFFFAOYSA-N ChemAxon polar_surface_area 83.14 ChemAxon refractivity 83.22 ChemAxon polarizability 30.82 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17941 Specdb::CMs 47109 Specdb::CMs 165555 Specdb::MsMs 305764 Specdb::MsMs 305765 Specdb::MsMs 305766 Specdb::MsMs 349237 Specdb::MsMs 349238 Specdb::MsMs 349239 Specdb::MsMs 2747353 Specdb::MsMs 2747354 Specdb::MsMs 2747355 Specdb::MsMs 2931150 Specdb::MsMs 2931151 Specdb::MsMs 2931152 HMDB41087 #<Reference:0x000055ce333e0a60> Citrus Unknown generic