HMDB0032055 RDKit 3D N-Acetylhistidine 25 25 0 0 0 0 0 0 0 0999 V2000 2.8669 -1.5708 -0.8059 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0812 -0.3936 -0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 0.6754 -1.0681 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1456 -0.3840 0.6533 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3878 0.7700 1.0382 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.0977 0.4809 0.9756 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5016 0.1012 -0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8079 -0.2218 -0.7585 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8032 -0.5111 -2.0617 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5454 -0.3782 -2.5107 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7447 -0.0045 -1.4981 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6609 1.2209 2.4107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4856 0.6089 3.1147 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0076 2.3175 2.9199 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8757 -1.2404 -1.0958 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0089 -2.2026 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3639 -2.1989 -1.5646 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9984 -1.2718 1.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6233 1.6401 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 1.2827 1.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2576 -0.4178 1.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6402 -0.2276 -0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6305 -0.7959 -2.6528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2204 -0.5488 -3.5471 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1527 3.2701 2.6341 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 10 11 2 0 5 12 1 0 12 13 2 0 12 14 1 0 11 7 1 0 1 15 1 0 1 16 1 0 1 17 1 0 4 18 1 0 5 19 1 6 6 20 1 0 6 21 1 0 8 22 1 0 9 23 1 0 10 24 1 0 14 25 1 0 M END