1.0 2010-04-08 22:05:13 UTC 2020-02-24 19:10:24 UTC FDB002039 Laurotetanine Alkaloid from the leaves of Peumus boldus (boldo). Laurotetanine is found in cherimoya. (+)-Laurotetanine 6a&alpha;-Noraporphin-9-ol, 1,2, 10-trimethoxy- 6Aalpha 1,2,10-trimethoxy--noraporphin-9-ol 9-Hydroxy-1,2,10-trimethoxynoraporphine Laurotetanin Laurotetanine Litsoeine Litsoene C19H21NO4 327.3743 327.147058165 4,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-5-ol 4,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-5-ol 128-76-7 COC1=C(O)C=C2CC3NCCC4=CC(OC)=C(OC)C(C2=C1)=C34 InChI=1S/C19H21NO4/c1-22-15-9-12-11(7-14(15)21)6-13-17-10(4-5-20-13)8-16(23-2)19(24-3)18(12)17/h7-9,13,20-21H,4-6H2,1-3H3 GVVXPMORGFYVOO-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-2-unsubstituted benzenoids Alkyl aryl ethers Anisoles Aralkylamines Azacyclic compounds Benzoquinolines Dialkylamines Hydrocarbon derivatives Naphthalenes Organopnictogen compounds Phenanthrenes and derivatives Tetrahydroisoquinolines 1-hydroxy-2-unsubstituted benzenoid 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 1.61 ALOGPS logs -3.93 ALOGPS solubility 3.81e-02 g/l ALOGPS melting_point Mp 125° logp 1.97 ChemAxon pka_strongest_acidic 9.95 ChemAxon pka_strongest_basic 9.23 ChemAxon iupac 4,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-5-ol ChemAxon average_mass 327.3743 ChemAxon mono_mass 327.147058165 ChemAxon smiles COC1=C(O)C=C2CC3NCCC4=CC(OC)=C(OC)C(C2=C1)=C34 ChemAxon formula C19H21NO4 ChemAxon inchi InChI=1S/C19H21NO4/c1-22-15-9-12-11(7-14(15)21)6-13-17-10(4-5-20-13)8-16(23-2)19(24-3)18(12)17/h7-9,13,20-21H,4-6H2,1-3H3 ChemAxon inchikey GVVXPMORGFYVOO-UHFFFAOYSA-N ChemAxon polar_surface_area 59.95 ChemAxon refractivity 92.1 ChemAxon polarizability 35.64 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge 1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14714 Specdb::CMs 41829 Specdb::CMs 172273 Specdb::MsMs 101088 Specdb::MsMs 101089 Specdb::MsMs 101090 Specdb::MsMs 166608 Specdb::MsMs 166609 Specdb::MsMs 166610 Specdb::MsMs 452145 Specdb::MsMs 2776448 Specdb::MsMs 2776449 Specdb::MsMs 2776450 Specdb::MsMs 2901648 Specdb::MsMs 2901649 Specdb::MsMs 2901650 HMDB30220 #<Reference:0x000055ce31e59070> Cherimoya Type 1 specific Annona cherimola 49314