Mrv0541 04121514112D 20 19 0 0 0 0 999 V2000 -8.7651 -0.9355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0506 -0.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3362 -0.9355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6217 -0.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9072 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1927 0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4783 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7638 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0493 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3349 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6204 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9059 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1914 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 1.9520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2375 0.7145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3809 1.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6664 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 3 0 0 0 0 5 6 1 0 0 0 0 6 7 3 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 10 9 1 4 0 0 0 10 11 2 0 0 0 0 12 11 1 4 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M END > NP0330174 > NP-MRD > CCCC#CC#CCCC=CC=CC(=O)NCC(C)C > InChI=1S/C18H25NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(20)19-16-17(2)3/h12-15,17H,4-5,10-11,16H2,1-3H3,(H,19,20) > CAZNLADLZFVEBY-UHFFFAOYSA-N > C18H25NO > 271.404 > 271.193614429 > 1 > 45 > 34.932648063468555 > 1 > 1 > 0 > 1 > N-(2-methylpropyl)tetradeca-2,4-dien-8,10-diynamide > 5.27 > 4.833797238 > -4.73 > 0 > 0 > 0 > 15.806947768537352 > -0.13415655416255567 > 29.1 > 89.2774 > 10 > 1 > 5.03e-03 g/l > N-(2-methylpropyl)tetradeca-2,4-dien-8,10-diynamide > 1 > NP0330174 > n-(2-methylpropyl)tetradeca-2,4-dien-8,10-diynimidic acid $$$$