HMDB0028899 RDKit 3D Histidinyl-Gamma-glutamate 37 37 0 0 0 0 0 0 0 0999 V2000 3.7978 1.1471 0.9463 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4447 0.0439 0.2883 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7832 -0.3910 -0.9706 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3767 -0.8627 -0.8848 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4004 0.1617 -0.4736 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7552 1.3666 -0.4569 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0598 -0.1998 -0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8933 0.7630 0.3039 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5415 1.9815 0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2683 0.4500 0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0421 1.5933 1.0615 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0164 -0.3607 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3856 -0.6077 0.1903 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7836 -1.6813 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0912 -1.5936 1.2551 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5272 -0.4645 0.6771 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5018 0.1261 0.0382 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8509 0.3872 -0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3054 1.5046 0.2222 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6266 -0.5462 -0.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8427 0.9912 1.9803 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2246 2.0729 0.7139 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4553 -0.8540 1.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4069 -1.1875 -1.4854 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8646 0.4911 -1.6844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3173 -1.7135 -0.1568 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -1.3243 -1.8656 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2018 -1.1938 -0.1187 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2014 -0.2057 1.6166 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5734 2.2506 1.6991 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3794 2.0664 0.1865 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5488 -1.3539 -0.5042 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 0.1902 -1.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1362 -2.5058 1.2917 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5465 -0.0700 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5244 1.0174 -0.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6697 -1.4888 -0.3214 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 2 0 5 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 2 18 1 0 18 19 2 0 18 20 1 0 17 13 1 0 1 21 1 0 1 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 7 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 12 32 1 0 12 33 1 0 14 34 1 0 16 35 1 0 17 36 1 0 20 37 1 0 M END