HMDB0252607 RDKit 3D 4-Aminohex-5-ynoic acid 18 17 0 0 0 0 0 0 0 0999 V2000 -2.3493 1.7994 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8134 0.7165 -0.1155 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1469 -0.5816 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8707 -1.5277 0.6308 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -0.4781 0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9836 0.5813 -0.4037 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3672 0.7664 0.1112 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1097 1.6100 -0.4409 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7993 0.0027 1.1865 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8096 2.7522 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1104 -0.8992 -1.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2908 -2.3464 0.8354 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8278 -1.7036 0.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.1768 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7654 -1.4604 0.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0243 0.2573 -1.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4019 1.5126 -0.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3772 -0.8244 1.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 1 10 1 0 3 11 1 0 4 12 1 0 4 13 1 0 5 14 1 0 5 15 1 0 6 16 1 0 6 17 1 0 9 18 1 0 M END