HMDB0028708 RDKit 3D Arginylglutamic acid 42 41 0 0 0 0 0 0 0 0999 V2000 5.8883 1.5913 -1.4526 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8604 0.6719 -0.5448 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9443 -0.2555 -0.5063 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8053 0.5565 0.3983 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5159 0.0293 0.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 -0.0073 1.1571 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1974 -0.5559 0.7926 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5346 0.2569 -0.2682 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3716 1.6076 0.2119 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7399 -0.3160 -0.7349 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7368 -1.4916 -1.1786 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9811 0.3761 -0.7168 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -0.1971 -1.1737 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2662 -0.2638 -0.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8267 -1.0955 1.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9097 -1.1062 2.0775 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9694 -0.4912 1.8621 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7577 -1.7996 3.2585 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7484 0.6055 -2.2809 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1443 1.6145 -2.6802 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 0.2365 -2.8778 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1124 2.2803 -1.5043 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9383 0.0633 -0.4679 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7843 -1.2861 -0.5151 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9384 0.8489 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1578 0.6765 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6894 -1.0137 -0.3335 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0022 -0.6086 1.9796 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4063 1.0133 1.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.5853 1.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3766 -1.6183 0.4631 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.2488 -1.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4946 1.6290 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0181 2.2208 -0.2944 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9752 1.3519 -0.3479 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0178 -1.2395 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5851 0.7491 0.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1467 -0.7700 -0.5414 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8694 -0.7392 1.5163 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -2.1526 0.7912 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9537 -1.3748 4.1613 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9752 0.3399 -3.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 13 19 1 0 19 20 2 0 19 21 1 0 1 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 5 26 1 0 5 27 1 0 6 28 1 0 6 29 1 0 7 30 1 0 7 31 1 0 8 32 1 6 9 33 1 0 9 34 1 0 12 35 1 0 13 36 1 6 14 37 1 0 14 38 1 0 15 39 1 0 15 40 1 0 18 41 1 0 21 42 1 0 M END