HMDB0001263 RDKit 3D Allysine 21 20 0 0 0 0 0 0 0 0999 V2000 1.0379 -1.2244 -1.0501 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8705 0.0339 -0.3542 C 0 0 1 0 0 0 0 0 0 0 0 0 0.2721 -0.2858 0.9977 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0522 -0.9700 0.7965 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -0.1528 0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3876 1.1228 0.7014 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9017 1.4714 1.7416 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1629 0.7077 -0.2759 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1752 0.1630 -0.7772 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3253 1.9416 0.3368 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3889 -1.9217 -0.3376 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7764 -1.0906 -1.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1533 0.7053 -0.8705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2495 0.5637 1.6795 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9431 -1.0537 1.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4841 -1.3420 1.7449 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8445 -1.8816 0.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9918 -0.7772 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7605 0.0200 -1.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1067 1.7662 0.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2259 2.2042 0.7471 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 2 0 2 8 1 0 8 9 2 0 8 10 1 0 1 11 1 0 1 12 1 0 2 13 1 6 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 10 21 1 0 M END