1.0 2010-04-08 22:05:15 UTC 2020-02-24 19:10:25 UTC FDB002124 Muricinine Alkaloid from Annona muricata (soursop). Muricinine is found in custard apple, fruits, and soursop. 1,11-Dihydroxy-2,10-dimethoxynoraporphine Muricinine C18H19NO4 313.3478 313.131408101 4,15-dimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2(7),3,5,13,15-hexaene-3,16-diol 4,15-dimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2(7),3,5,13,15-hexaene-3,16-diol COC1=C(O)C2=C(CC3NCCC4=CC(OC)=C(O)C2=C34)C=C1 InChI=1S/C18H19NO4/c1-22-12-4-3-9-7-11-14-10(5-6-19-11)8-13(23-2)18(21)16(14)15(9)17(12)20/h3-4,8,11,19-21H,5-7H2,1-2H3 POIRVLZGTSWEMG-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 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Anisoles Aralkylamines Azacyclic compounds Benzoquinolines Dialkylamines Hydrocarbon derivatives Naphthols and derivatives Organopnictogen compounds Phenanthrenes and derivatives Tetrahydroisoquinolines 1-hydroxy-4-unsubstituted benzenoid 1-naphthol Alkyl aryl ether Amine Anisole Aporphine Aralkylamine Aromatic heteropolycyclic compound Azacycle Benzenoid Benzoquinoline Ether Hydrocarbon derivative Naphthalene Organic nitrogen compound Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenanthrene Quinoline Secondary aliphatic amine Secondary amine Tetrahydroisoquinoline logp 1.64 ALOGPS logs -2.90 ALOGPS solubility 3.91e-01 g/l ALOGPS logp 1.79 ChemAxon pka_strongest_acidic 9.53 ChemAxon pka_strongest_basic 8.89 ChemAxon iupac 4,15-dimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2(7),3,5,13,15-hexaene-3,16-diol ChemAxon average_mass 313.3478 ChemAxon mono_mass 313.131408101 ChemAxon smiles COC1=C(O)C2=C(CC3NCCC4=CC(OC)=C(O)C2=C34)C=C1 ChemAxon formula C18H19NO4 ChemAxon inchi InChI=1S/C18H19NO4/c1-22-12-4-3-9-7-11-14-10(5-6-19-11)8-13(23-2)18(21)16(14)15(9)17(12)20/h3-4,8,11,19-21H,5-7H2,1-2H3 ChemAxon inchikey POIRVLZGTSWEMG-UHFFFAOYSA-N ChemAxon polar_surface_area 70.95 ChemAxon refractivity 87.62 ChemAxon polarizability 33.53 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13500 Specdb::CMs 41862 Specdb::CMs 160465 Specdb::MsMs 47700 Specdb::MsMs 47701 Specdb::MsMs 47702 Specdb::MsMs 112575 Specdb::MsMs 112576 Specdb::MsMs 112577 Specdb::MsMs 2731761 Specdb::MsMs 2731762 Specdb::MsMs 2731763 Specdb::MsMs 2977658 Specdb::MsMs 2977659 Specdb::MsMs 2977660 HMDB30288 #<Reference:0x000055ce33262198> Custard apple Type 1 specific Annona reticulata 301862 Fruits Unknown generic Soursop Type 1 specific Annona muricata 13337