Ketcher 01041718252D 1 1.00000 0.00000 0 26 29 0 1 0 999 V2000 19.3556 -13.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4953 -14.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2201 -14.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3597 -12.7044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4995 -15.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6224 -13.7067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2158 -15.2018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0970 -13.7151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4953 -12.1992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2326 -12.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3513 -15.7029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6350 -15.6987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6224 -12.7044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7579 -14.2079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1013 -12.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9573 -14.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9573 -13.2013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3513 -16.6969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6350 -16.6926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7622 -15.1892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7497 -12.1992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4953 -17.1896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7579 -17.1771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8769 -12.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8936 -16.6759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0846 -14.7048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 4 9 2 0 0 0 4 10 1 0 0 0 5 11 2 0 0 0 5 12 1 0 0 0 6 13 2 0 0 0 6 14 1 0 0 0 8 15 1 0 0 0 8 16 1 0 0 0 8 17 1 0 0 0 11 18 1 0 0 0 12 19 2 0 0 0 12 20 1 0 0 0 13 21 1 0 0 0 18 22 2 0 0 0 19 23 1 0 0 0 21 24 1 0 0 0 23 25 1 0 0 0 7 11 1 0 0 0 9 13 1 0 0 0 10 15 1 0 0 0 19 22 1 0 0 0 3 26 1 6 0 0 M CHG 1 8 1 M END > CHEBI:6641 > (S)-magnoflorine > An aporphine alkaloid that is (S)-corytuberine in which the nitrogen has been quaternised by an additional methyl group. > 3 > magnoflorine; magnoflorine; (+)-magnoflorine > (6aS)-1,11-dihydroxy-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium > C20H24NO4 > 342.410 > 342.16998 > 1 > C12=C3C4=C(C=CC(=C4O)OC)C[C@@]1([N+](CCC2=CC(=C3O)OC)(C)C)[H] > InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1 > YLRXAIKMLINXQY-ZDUSSCGKSA-O > 2141-09-5 > 1553619 > 2141-09-5 > C09581 > C00001885 > CPD-9936 > Magnoflorine > 17973202; 20120110; 21473145; 23456265; 24310099; 24337185; 25611590; 25840917; 26873213; 26884929; 27209587; 27634038 $$$$