Ketcher 10072009482D 1 1.00000 0.00000 0 29 31 0 1 0 999 V2000 10.1422 -6.9775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2763 -6.4774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4102 -6.9773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4101 -7.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2762 -8.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1421 -7.9774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -8.4773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5442 -6.4773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2763 -5.4774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0081 -8.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0081 -9.4775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8742 -7.9775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7402 -8.4776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6063 -7.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7401 -9.4774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6062 -9.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1888 -10.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5197 -9.5707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7106 -10.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6888 -11.1800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4722 -8.4775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6063 -6.9775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7971 -6.3897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4153 -6.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1063 -5.4387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1062 -5.4387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3663 -6.6989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1095 -6.0296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5742 -7.6769 0.0000 N 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 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 4 7 2 0 0 0 3 8 1 0 0 0 2 9 2 0 0 0 6 10 1 6 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 13 15 1 6 0 0 15 16 1 0 0 0 16 18 1 0 0 0 16 19 2 0 0 0 17 18 2 0 0 0 17 20 1 0 0 0 19 20 1 0 0 0 14 21 2 0 0 0 14 22 1 0 0 0 23 22 1 0 0 0 22 24 1 0 0 0 23 26 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 24 27 1 1 0 0 27 28 2 0 0 0 27 29 1 0 0 0 M END > CHEBI:135653 > taltirelin > An oligopeptide comprising of (4S)-1-methyl-2,6-dioxohexahydropyrimidine-4-carboxylic acid, L-histidine and L-prolinamide joined in sequence by peptide linkages. It is a thyrotropin-releasing hormone (TRH) analog. Its tetrahydrate form is approved in Japan for the treatment of spinal muscular atrophy. > 3 > TA-0910; TA 0910; 1-methyl-(S)-4,5-dihydroorotyl-L-histidyl-L-prolinamide > N-{[(4S)-1-methyl-2,6-dioxohexahydropyrimidin-4-yl]carbonyl}-L-histidyl-L-prolinamide > taltirelinum; taltireline; taltirelina; taltirelin > C17H23N7O5 > 405.415 > 405.17607 > 0 > CN1C(=O)C[C@H](NC1=O)C(=O)N[C@@H](CC1=CNC=N1)C(=O)N1CCC[C@H]1C(N)=O > InChI=1S/C17H23N7O5/c1-23-13(25)6-10(22-17(23)29)15(27)21-11(5-9-7-19-8-20-9)16(28)24-4-2-3-12(24)14(18)26/h7-8,10-12H,2-6H2,1H3,(H2,18,26)(H,19,20)(H,21,27)(H,22,29)/t10-,11-,12-/m0/s1 > LQZAIAZUDWIVPM-SRVKXCTJSA-N > 103300-74-9 > 103300-74-9 > Taltirelin > PMC7487885 > 1590553; 1904115; 2115588; 23087672; 28720519; 29674333; 30555300; 30618632; 32227104; 7768282; 7847606; 7862253; 7918782; 8142670; 8835640; 8892518; 9113262; 9430093; 9608876; 9777599 $$$$