Ketcher 03261812402D 1 1.00000 0.00000 0 27 28 0 0 0 999 V2000 21.0844 -10.0624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.8901 -9.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5860 -8.5300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5800 -8.5300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2748 -9.4761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4427 -13.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4361 -12.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5657 -12.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7018 -12.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7083 -13.9896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5788 -14.4840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3134 -14.4727 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 18.5591 -11.4823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6887 -10.9878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4230 -10.9764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4165 -9.9757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7492 -9.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7378 -10.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5972 -11.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.5866 -12.5064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.4709 -11.0172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 24.4893 -10.0169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0888 -11.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2926 -11.4703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5470 -9.4818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.6298 -9.5174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8572 -11.4647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 5 1 1 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 11 6 2 0 0 0 6 12 1 0 0 0 8 13 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 15 16 2 0 0 0 5 16 1 0 0 0 2 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 19 21 1 0 0 0 21 22 1 0 0 0 1 23 1 0 0 0 15 24 1 4 0 0 16 25 1 4 0 0 17 26 1 4 0 0 18 27 1 4 0 0 M END > CHEBI:140475 > MC1568 > A hydroxamic acid that is N-methylpyrrole which is substituted at positions 2 and 5 by 3-(hydroxyamino)-3-oxoprop-1-en-1-yl and 3-(m-fluorophenyl)-3-oxoprop-1-en-1-yl groups, respectively. It is a potent and selective inhibitor of class II (IIa) histone deacetylase (HDAC II). > 3 > MC-1568 > 3-{5-[3-(3-fluorophenyl)-3-oxoprop-1-en-1-yl]-1-methyl-1H-pyrrol-2-yl}-N-hydroxyacrylamide > C17H15FN2O3 > 314.312 > 314.10667 > 0 > N1(C(=CC=C1C(=C(C(C2=CC(=CC=C2)F)=O)[H])[H])C(=C(C(=O)NO)[H])[H])C > InChI=1S/C17H15FN2O3/c1-20-14(5-6-15(20)8-10-17(22)19-23)7-9-16(21)12-3-2-4-13(18)11-12/h2-11,23H,1H3,(H,19,22) > QQDIFLSJMFDTCQ-UHFFFAOYSA-N > 852475-26-4 > 26700969 > 15857140; 23176534; 24450497; 27103167; 27660204; 27739328; 28732762; 29401190; 29412739; 29482060 $$$$