HMDB0001901 RDKit 3D Aminocaproic acid 22 21 0 0 0 0 0 0 0 0999 V2000 3.0392 0.7386 0.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7633 -0.6464 0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4454 -1.0351 -0.2875 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3907 -0.1198 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9792 -0.4258 -0.3089 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9529 0.5383 0.3427 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3234 0.3721 -0.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5882 -0.4994 -1.0012 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3269 1.1829 0.3657 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 0.8832 0.2407 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5589 1.3193 0.8319 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5374 -1.3225 -0.0246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7191 -0.8003 1.4707 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1803 -2.0869 -0.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5529 -0.9398 -1.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3084 -0.3816 1.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6566 0.9318 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2064 -1.4699 -0.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9639 -0.3415 -1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5692 1.5781 0.2181 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9512 0.3518 1.4381 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3728 2.1729 0.2578 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 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 1 10 1 0 1 11 1 0 2 12 1 0 2 13 1 0 3 14 1 0 3 15 1 0 4 16 1 0 4 17 1 0 5 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 9 22 1 0 M END