HMDB0015154 RDKit 3D Bethanechol 28 27 0 0 0 0 0 0 0 0999 V2000 0.6360 -0.6173 -1.7729 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8123 -0.4742 -0.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0221 0.6365 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 0.4600 0.1624 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.8531 -0.8710 0.5393 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9704 0.7702 -1.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0679 1.3736 1.1227 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1798 -0.1067 -0.0397 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0464 -0.9224 0.6737 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3855 -0.4904 0.8549 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5944 -2.0009 1.1202 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0368 -1.4498 -2.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6203 -0.8782 -2.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3425 0.3484 -2.2332 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6613 -1.4405 0.2142 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2241 0.7411 1.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2869 1.5826 -0.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3636 -1.6723 -0.0153 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9522 -0.9514 0.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7426 -1.0213 1.6293 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5143 1.7042 -1.5455 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9881 -0.0630 -1.8357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0534 1.0497 -0.9613 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0418 1.7312 0.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4293 2.2966 1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1181 0.9173 2.1337 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7771 -0.3206 1.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 -0.3313 0.0402 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 4 6 1 0 4 7 1 0 2 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 5 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 7 26 1 0 10 27 1 0 10 28 1 0 M CHG 1 4 1 M END