Ketcher 07192115322D 1 1.00000 0.00000 0 30 31 0 0 0 999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8659 0.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8659 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7319 -0.9999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7319 2.0002 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 1.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4639 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8662 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8172 1.8090 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8172 0.1910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1263 -0.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 0.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8662 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9051 1.8661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9051 1.8659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9052 3.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 2.7319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9051 3.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4051 4.4638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9052 5.3300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4052 4.4639 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 8.9051 3.5978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4051 2.7318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9051 3.5978 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 6.4051 4.4639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4051 2.7319 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 1.8658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16 1 1 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 3 6 1 0 0 0 4 7 2 0 0 0 5 8 2 0 0 0 8 9 1 0 0 0 7 8 1 0 0 0 11 14 1 0 0 0 11 10 1 0 0 0 14 12 2 0 0 0 12 16 1 0 0 0 16 10 2 0 0 0 12 13 1 0 0 0 14 15 1 0 0 0 15 17 1 0 0 0 17 18 1 0 0 0 18 29 1 0 0 0 29 20 1 0 0 0 29 19 2 0 0 0 20 27 1 0 0 0 27 21 1 0 0 0 21 24 1 0 0 0 24 22 1 0 0 0 24 23 2 0 0 0 24 25 1 0 0 0 27 26 1 0 0 0 27 28 2 0 0 0 29 30 1 0 0 0 M CHG 1 16 1 M END > CHEBI:9534 > thiamine(1+) triphosphate > A thiamine phosphate that is thiamine(1+) in which the hydroxy group is replaced by a triphosphate group. It is found in low amounts in most vertebrate tissues and can phosphorylate certain proteins. > 3 > TTP; ThTP; thiamine triphosphoric acid ester; thiamine triphosphate; thiamin triphosphate; 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-{2-[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)oxy]ethyl}-4-methyl-1,3-thiazol-3-ium; 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,8,8-trihydroxy-4,6,8-trioxido-3,5,7-trioxa-4,6,8-triphosphaoct-1-yl)-thiazolium > 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-[2-(triphosphooxy)ethyl]-4-methyl-1,3-thiazol-3-ium > C12H20N4O10P3S > 505.290 > 505.01075 > 1 > CC1=C(CCOP(O)(=O)OP(O)(=O)OP(O)(O)=O)SC=[N+]1CC1=C(N)N=C(C)N=C1 > InChI=1S/C12H19N4O10P3S/c1-8-11(30-7-16(8)6-10-5-14-9(2)15-12(10)13)3-4-24-28(20,21)26-29(22,23)25-27(17,18)19/h5,7H,3-4,6H2,1-2H3,(H5-,13,14,15,17,18,19,20,21,22,23)/p+1 > IWLROWZYZPNOFC-UHFFFAOYSA-O > 3808304 > 50851-39-3 > C03028 > V4E > IND605935172 > 12379473; 12943234; 1294713; 1297771; 14769791; 1506715; 18215312; 19490098; 19906644; 23323214; 24590690; 26221030; 29223015; 3010036; 3039089; 31941143; 32885135; 6329572 $$$$