CDK 2/12/10,15:27 21 23 0 0 0 0 0 0 0 0999 V2000 -0.7145 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 1.6500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0738 -1.3395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8782 -1.1559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2362 -0.4127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8783 0.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 0.5143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7353 -0.6293 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0208 -0.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19 1 1 6 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 3 7 1 0 0 0 0 3 5 1 6 0 0 0 2 4 2 0 0 0 0 6 5 1 0 0 0 0 8 7 2 0 0 0 0 7 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 14 13 1 0 0 0 0 15 13 1 0 0 0 0 13 20 1 1 0 0 0 19 14 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 17 20 1 1 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 20 1 M END > CHEBI:58164 > (S)-atropinium > An organic cation that is the conjugate acid of (S)-atropine arising from protonation of the tertiary amino group; major species at pH 7.3. > 3 > L-hyoscyamine; (S)-atropinium(1+); (S)-atropinium cation > (3-endo)-8-methyl-8-azoniabicyclo[3.2.1]oct-3-yl (2S)-3-hydroxy-2-phenylpropanoate > C17H24NO3 > 290.37740 > 290.17507 > 1 > C[NH+]1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)[C@H](CO)c1ccccc1 > InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/p+1/t13-,14+,15+,16-/m1/s1 > RKUNBYITZUJHSG-FXUDXRNXSA-O $$$$