Ketcher 12051916572D 1 1.00000 0.00000 0 42 45 0 1 0 999 V2000 6.9912 -12.2410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1237 -12.7418 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1236 -13.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9911 -14.2442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8586 -13.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8586 -12.7418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8112 -12.4323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 -13.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8112 -14.0530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1207 -15.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5319 -15.8160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1206 -16.6265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0732 -16.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8833 -16.9062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0733 -15.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8094 -17.5791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 -19.0816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 -18.0799 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 6.9419 -17.0783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0745 -17.5791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2071 -19.0816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2071 -18.0799 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.2071 -17.0544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3396 -17.5791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4723 -19.0816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6048 -17.5791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4723 -18.0799 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 3.4723 -17.0783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8110 -17.5791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8836 -14.7266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6697 -16.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2561 -14.2442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9912 -11.2393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6776 -15.4588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5332 -16.9681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5253 -17.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4046 -16.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3889 -18.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2680 -16.9817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2601 -17.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6539 -18.4636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6461 -19.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 5 9 1 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 10 9 1 1 0 0 10 11 1 0 0 0 10 15 1 0 0 0 11 12 1 0 0 0 12 29 1 1 0 0 12 13 1 0 0 0 13 14 1 6 0 0 13 15 1 0 0 0 16 18 1 0 0 0 18 17 2 0 0 0 18 20 1 0 0 0 18 19 1 0 0 0 20 22 1 0 0 0 22 21 2 0 0 0 22 24 1 0 0 0 22 23 1 0 0 0 24 27 1 0 0 0 27 25 2 0 0 0 27 26 1 0 0 0 27 28 1 0 0 0 29 16 1 0 0 0 15 30 1 6 0 0 14 31 1 0 0 0 3 32 1 0 0 0 1 33 2 0 0 0 31 34 2 0 0 0 31 35 1 0 0 0 35 36 1 0 0 0 35 37 2 0 0 0 36 38 2 0 0 0 37 39 1 0 0 0 38 40 1 0 0 0 39 40 2 0 0 0 36 41 1 0 0 0 41 42 1 0 0 0 M END > CHEBI:145576 > 3'-MANT-GTP > A purine ribonucleoside 5'-triphosphate that is GTP substituted at the 3' position by an N-methylanthraniloyl group. > 3 > 3'-O-(N-methylanthraniloyl)guanosine triphosphate > 3'-O-[2-(methylamino)benzoyl]guanosine 5'-(tetrahydrogen triphosphate) > C18H23N6O15P3 > 656.330 > 656.04343 > 0 > C1(NC(=NC2=C1N=CN2[C@@H]3O[C@H](COP(=O)(OP(=O)(OP(=O)(O)O)O)O)[C@@H](OC(=O)C=4C(=CC=CC4)NC)[C@H]3O)N)=O > InChI=1S/C18H23N6O15P3/c1-20-9-5-3-2-4-8(9)17(27)37-13-10(6-35-41(31,32)39-42(33,34)38-40(28,29)30)36-16(12(13)25)24-7-21-11-14(24)22-18(19)23-15(11)26/h2-5,7,10,12-13,16,20,25H,6H2,1H3,(H,31,32)(H,33,34)(H2,28,29,30)(H3,19,22,23,26)/t10-,12-,13-,16-/m1/s1 > DSPRYHPLXXUNHS-XNIJJKJLSA-N > 26247422 $$$$