Mrv0541 08291401212D 12 13 0 0 0 0 999 V2000 1.8179 3.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 0.5961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0044 0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5961 0.5961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5961 1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3201 2.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1794 0.0127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0044 2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1794 2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4284 1.0086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1381 2.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 2 1 0 0 0 0 4 2 1 0 0 0 0 6 5 1 0 0 0 0 7 1 1 0 0 0 0 8 3 1 0 0 0 0 8 5 1 0 0 0 0 9 4 2 0 0 0 0 9 7 1 0 0 0 0 10 6 1 0 0 0 0 10 9 1 0 0 0 0 11 8 1 0 0 0 0 11 10 1 0 0 0 0 12 7 2 0 0 0 0 M END > T3D4124 > t3db > CC(=O)C1=CCCC2CCC1N2 > InChI=1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3 > SGNXVBOIDPPRJJ-UHFFFAOYSA-N > C10H15NO > 165.2322 > 165.115364107 > 2 > 27 > 18.59302053151166 > 1 > 1 > 0 > 1 > 1-{9-azabicyclo[4.2.1]non-2-en-2-yl}ethan-1-one > 1.25 > 1.1860531283333335 > -1.47 > 0 > 2 > 1 > 19.11709083444006 > 10.214898524857313 > 29.1 > 48.8307 > 1 > 1 > 5.57e+00 g/l > anatoxin-a > 1 > T3D4124 > Anatoxin a > 64285-06-9 > Organic Compound; Amine; Ester; Bacterial Toxin; Natural Compound $$$$