Ketcher 08242215002D 1 1.00000 0.00000 0 41 46 0 1 0 999 V2000 8.6031 -12.1058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6030 -13.1064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7365 -11.6054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7363 -13.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 -12.1056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8699 -13.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5547 -11.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1427 -12.6062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5547 -13.4157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1429 -10.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0944 -11.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0944 -12.2970 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9608 -10.7963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8272 -11.2966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9608 -12.7972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8272 -12.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9666 -10.9871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7309 -13.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9899 -10.3014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9608 -9.7957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9608 -13.7978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8639 -14.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1944 -15.1108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2156 -14.9028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8155 -14.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6075 -15.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6937 -12.7973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5668 -12.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4685 -12.7152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6668 -11.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1474 -11.9815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6465 -11.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0087 -10.5722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3157 -9.6229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9615 -10.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2954 -9.4195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6719 -13.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9251 -14.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1284 -15.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6516 -13.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3379 -14.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 2 4 2 0 0 0 3 5 1 0 0 0 4 6 1 0 0 0 5 6 2 0 0 0 1 7 1 0 0 0 1 2 1 0 0 0 2 9 1 0 0 0 8 9 1 0 0 0 7 10 1 0 0 0 7 8 1 0 0 0 10 11 1 0 0 0 8 12 1 0 0 0 11 13 1 0 0 0 11 12 1 0 0 0 13 14 1 0 0 0 12 15 1 0 0 0 14 16 1 0 0 0 15 16 1 0 0 0 7 17 1 6 0 0 8 18 1 6 0 0 11 19 1 6 0 0 13 20 2 0 0 0 15 21 2 0 0 0 9 22 1 0 0 0 22 23 1 0 0 0 23 24 2 0 0 0 22 25 1 0 0 0 22 26 1 0 0 0 16 27 1 1 0 0 27 28 1 0 0 0 28 29 2 0 0 0 28 30 1 0 0 0 29 31 1 0 0 0 31 32 1 0 0 0 30 33 1 0 0 0 30 32 2 0 0 0 33 34 2 0 0 0 32 35 1 0 0 0 34 36 1 0 0 0 35 36 2 0 0 0 29 37 1 0 0 0 37 38 1 0 0 0 38 39 2 0 0 0 37 40 1 0 0 0 37 41 1 0 0 0 M END > CHEBI:193028 > okaramine C > An indole alkaloid isolated from Penicillium simplicissimum. It exhibits insecticidal activity. > 3 > (+)-okaramine C > (3S,5aR,10bS,11aS)-10b-hydroxy-6-(2-methylbut-3-en-2-yl)-3-{[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methyl}-6,10b,11,11a-tetrahydro-2H-pyrazino[1',2':1,5]pyrrolo[2,3-b]indole-1,4(3H,5aH)-dione > C32H36N4O3 > 524.665 > 524.27874 > 0 > [H][C@@]12C[C@]3(O)C4=CC=CC=C4N([C@]3([H])N1C(=O)[C@H](CC1=C(NC3=C1C=CC=C3)C(C)(C)C=C)NC2=O)C(C)(C)C=C > InChI=1S/C32H36N4O3/c1-7-30(3,4)26-20(19-13-9-11-15-22(19)33-26)17-23-28(38)35-25(27(37)34-23)18-32(39)21-14-10-12-16-24(21)36(29(32)35)31(5,6)8-2/h7-16,23,25,29,33,39H,1-2,17-18H2,3-6H3,(H,34,37)/t23-,25-,29-,32-/m0/s1 > YWLAQSLUIQTZON-FQPFCCRUSA-N > 142677-16-5 > 142677-16-5 > C00026640 > 15326519; 29168781; 32153648 $$$$