1.0 2010-04-08 22:04:33 UTC 2020-02-24 19:10:07 UTC FDB000398 Oxoglaucine Alkaloid from Annona purpurea (soncoya). Oxoglaucine is found in cherimoya, beverages, and fruits. 1,2,9,10-Tetramethoxy-7H-dibenzo(de,g)quinolin-7-one 1,2,9,10-Tetramethoxy-7H-dibenzo[de,g]quinolin-7-one 1,2,9,10-Tetramethoxy-7H-dibenzo[de,g]quinolin-7-one, 9CI 7H-Dibenzo(de,g)quinolin-7-one, 1,2,9,10-tetramethoxy- 7H-Dibenzo[de,g]quinolin-7-one, 1,2,9,10-tetramethoxy- Atheroline, o-methyl Liriodendron base O-Methylatheroline C20H17NO5 351.3527 351.110672659 4,5,15,16-tetramethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one 4,5,15,16-tetramethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one 5574-24-3 COC1=CC2=C(C=C1OC)C1=C(OC)C(OC)=CC3=C1C(=NC=C3)C2=O InChI=1S/C20H17NO5/c1-23-13-8-11-12(9-14(13)24-2)19(22)18-16-10(5-6-21-18)7-15(25-3)20(26-4)17(11)16/h5-9H,1-4H3 ZYKCETVKVRJFGD-UHFFFAOYSA-N belongs to the class of organic compounds known as aporphines. These are quinoline alkaloids containing the dibenzo[de,g]quinoline ring system or a dehydrogenated derivative thereof. Aporphines Organic compounds Alkaloids and derivatives Aporphines Aromatic heteropolycyclic compounds Alkyl aryl ethers Anisoles Aryl ketones Azacyclic compounds Benzoquinolines Heteroaromatic compounds Hydrocarbon derivatives Isoquinolines and derivatives Naphthalenes Organic oxides Organonitrogen compounds Organopnictogen compounds Phenanthrenes and derivatives Pyridines and derivatives Alkyl aryl ether Anisole Aporphine Aromatic heteropolycyclic compound Aryl ketone Azacycle Benzenoid Benzoquinoline Ether Heteroaromatic compound Hydrocarbon derivative Isoquinoline Ketone Naphthalene Organic nitrogen compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenanthrene Pyridine Quinoline logp 2.79 ALOGPS logs -3.36 ALOGPS solubility 1.53e-01 g/l ALOGPS melting_point Mp 227-229° (195-197°) logp 2.63 ChemAxon pka_strongest_basic 3.66 ChemAxon iupac 4,5,15,16-tetramethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one ChemAxon average_mass 351.3527 ChemAxon mono_mass 351.110672659 ChemAxon smiles COC1=CC2=C(C=C1OC)C1=C(OC)C(OC)=CC3=C1C(=NC=C3)C2=O ChemAxon formula C20H17NO5 ChemAxon inchi InChI=1S/C20H17NO5/c1-23-13-8-11-12(9-14(13)24-2)19(22)18-16-10(5-6-21-18)7-15(25-3)20(26-4)17(11)16/h5-9H,1-4H3 ChemAxon inchikey ZYKCETVKVRJFGD-UHFFFAOYSA-N ChemAxon polar_surface_area 66.88 ChemAxon refractivity 95.49 ChemAxon polarizability 36.6 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 6 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17598 Specdb::CMs 171572 Specdb::MsMs 109239 Specdb::MsMs 109240 Specdb::MsMs 109241 Specdb::MsMs 176646 Specdb::MsMs 176647 Specdb::MsMs 176648 Specdb::MsMs 449503 Specdb::MsMs 449504 Specdb::MsMs 449505 Specdb::MsMs 2245460 Specdb::MsMs 2246796 Specdb::MsMs 2247484 Specdb::MsMs 2438770 Specdb::MsMs 2438771 Specdb::MsMs 2438772 Specdb::MsMs 2523870 Specdb::MsMs 2523871 Specdb::MsMs 2523872 HMDB29337 #<Reference:0x000055ce31c6aea8> Beverages Unknown generic Cherimoya Type 1 specific Annona cherimola 49314 Fruits Unknown generic