Mrv0541 01151516122D 45 51 0 0 0 0 999 V2000 5.0093 -2.1362 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0093 -2.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2948 -1.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2948 -3.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5803 -2.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5803 -2.9612 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8658 -3.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8658 -4.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1514 -2.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4369 -3.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7238 -1.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7238 -0.8987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4383 -2.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4383 -0.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1527 -1.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1527 -0.8987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8672 -0.4862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8672 0.3388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5817 -0.8987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5818 0.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2962 -0.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2962 0.3388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0107 -0.8987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0107 -1.7237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2962 -2.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5817 -1.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2962 -2.9612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5817 -3.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8673 -2.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8673 -2.9611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1528 -3.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1527 -4.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4383 -2.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4382 -4.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7238 -3.3735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7238 -4.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4381 -5.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7236 -5.8483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0093 -4.6108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0092 -5.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1528 0.7513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0093 -0.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0093 0.3388 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.2948 -0.8987 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.2948 -0.0737 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 2 1 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 1 0 0 0 0 8 7 2 0 0 0 0 9 7 1 0 0 0 0 6 7 1 0 0 0 0 9 10 1 0 0 0 0 12 11 1 0 0 0 0 13 11 2 0 0 0 0 14 12 2 0 0 0 0 15 13 1 0 0 0 0 16 14 1 0 0 0 0 16 15 2 0 0 0 0 1 11 1 0 0 0 0 18 17 1 0 0 0 0 19 17 1 0 0 0 0 20 18 1 0 0 0 0 22 20 2 0 0 0 0 22 21 1 0 0 0 0 16 17 1 0 0 0 0 24 23 1 0 0 0 0 21 23 2 0 0 0 0 25 24 2 0 0 0 0 19 21 1 0 0 0 0 26 19 2 0 0 0 0 27 25 1 0 0 0 0 26 25 1 0 0 0 0 28 27 2 0 0 0 0 29 26 1 0 0 0 0 30 28 1 0 0 0 0 30 29 2 0 0 0 0 32 31 1 0 0 0 0 33 31 2 0 0 0 0 34 32 2 0 0 0 0 35 33 1 0 0 0 0 36 35 2 0 0 0 0 30 31 1 0 0 0 0 37 34 1 0 0 0 0 36 34 1 0 0 0 0 38 37 2 0 0 0 0 39 36 1 0 0 0 0 40 38 1 0 0 0 0 40 39 2 0 0 0 0 18 41 2 0 0 0 0 12 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M END > CHEBI:84327 > torin 1 > A member of the class of pyridoquinolines that is 9-(quinolin-3-yl)benzo[h][1,6]naphthyridin-2-one bearing an additional 4-(4-propionylpiperazin-1-yl)-3-(trifluoromethyl)phenyl substituent at position 1. It is a potent inhibitor of mTOR and exhibits anti-cancer properties. > 3 > torin1 > 1-[4-(4-propionylpiperazin-1-yl)-3-(trifluoromethyl)phenyl]-9-(quinolin-3-yl)benzo[h][1,6]naphthyridin-2(1H)-one > C35H28F3N5O2 > 607.62430 > 607.21951 > 0 > CCC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)-n1c2c(ccc1=O)cnc1ccc(cc21)-c1cnc2ccccc2c1 > InChI=1S/C35H28F3N5O2/c1-2-32(44)42-15-13-41(14-16-42)31-11-9-26(19-28(31)35(36,37)38)43-33(45)12-8-24-20-40-30-10-7-22(18-27(30)34(24)43)25-17-23-5-3-4-6-29(23)39-21-25/h3-12,17-21H,2,13-16H2,1H3 > AKCRNFFTGXBONI-UHFFFAOYSA-N > 20268275 > LSM-1079 > 20860370; 24424027; 25339775 $$$$