Ketcher 06112014052D 1 1.00000 0.00000 0 32 34 0 1 0 999 V2000 12.2076 -25.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2035 -26.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0823 -25.3863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3371 -25.3863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1993 -24.8798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3371 -27.3950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0740 -27.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9446 -25.8926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0907 -24.3860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4667 -25.8843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4667 -26.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9403 -26.8971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8192 -25.4030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9613 -23.8879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5920 -27.3910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8066 -27.3950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8276 -24.3985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6856 -25.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7024 -23.9005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7065 -22.9002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5770 -22.4021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8318 -22.4021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4475 -22.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3097 -22.3938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1802 -22.8919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.0506 -22.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1802 -23.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2257 -27.7762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0740 -26.3907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9362 -24.8840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8395 -28.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8365 -28.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 1 0 0 2 6 1 0 0 0 2 7 1 0 0 0 3 8 1 0 0 0 3 9 1 0 0 0 4 10 1 0 0 0 6 11 1 0 0 0 7 12 1 0 0 0 8 13 1 0 0 0 9 14 1 0 0 0 11 15 1 1 0 0 12 16 1 1 0 0 13 17 1 0 0 0 13 18 1 6 0 0 17 19 2 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 20 22 2 0 0 0 21 23 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 25 27 1 0 0 0 8 12 1 0 0 0 10 11 1 0 0 0 14 17 1 0 0 0 2 28 1 6 0 0 3 29 1 6 0 0 8 30 1 1 0 0 6 31 1 0 0 0 6 32 1 0 0 0 M END > CHEBI:3453 > cassaidine > A tricyclic diterpenoid that is is isolated from several plant species including Erythrophleum guineense and Erythrophleum ivorense. It is toxic with a digitalis like effect on the heart and a strong local anesthetic action. > 3 > cassaidine > 2-(dimethylamino)ethyl (2E)-[(13E)-3beta,7beta-dihydroxy-14alpha-methylpodocarpan-13-ylidene]acetate > C24H41NO4 > 407.595 > 407.30356 > 0 > [C@]12([C@](C([C@@H](O)CC1)(C)C)(C[C@H](O)[C@@]3([C@@]2(CC\C(\[C@@H]3C)=C/C(OCCN(C)C)=O)[H])[H])[H])C > InChI=1S/C24H41NO4/c1-15-16(13-21(28)29-12-11-25(5)6)7-8-17-22(15)18(26)14-19-23(2,3)20(27)9-10-24(17,19)4/h13,15,17-20,22,26-27H,7-12,14H2,1-6H3/b16-13+/t15-,17-,18-,19-,20-,22-,24+/m0/s1 > JKPVSFQJGXEMSU-CHEGSHICSA-N > 26296-41-3 > 26296-41-3 > C08669 > C00001625 > 1258661; 14955792; 5135168 $$$$