Mrv1652304272019212D 15 17 0 0 0 0 999 V2000 -0.0384 3.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1246 2.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4125 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5457 2.6330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2994 2.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8783 2.1481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4125 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9645 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7182 0.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3857 1.4769 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 0.1715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 10 2 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 14 1 0 0 0 0 9 12 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 M END > CDB006022 > CDB > CCC1=C2C(NC3=CC=CC=C23)=NC=C1 > InChI=1S/C13H12N2/c1-2-9-7-8-14-13-12(9)10-5-3-4-6-11(10)15-13/h3-8H,2H2,1H3,(H,14,15) > MLVRUBJDWFCNHK-UHFFFAOYSA-N > C13H12N2 > 196.253 > 196.100048394 > 1 > 27 > 22.05024810897243 > 1 > 1 > 0 > 1 > 4-ethyl-9H-pyrido[2,3-b]indole > 3.79 > 3.198665371666666 > -3.59 > 0 > 3 > 0 > 14.053342394773939 > 2.8461682608609458 > 28.68 > 60.9101 > 1 > 1 > 5.04e-02 g/l > 4-ethyl-9H-pyrido[2,3-b]indole > 1 > CDB006022 > 4-Ethyl alpha-carboline $$$$