HMDB0029013 RDKit 3D Prolyl-Aspartate 30 30 0 0 0 0 0 0 0 0999 V2000 4.6563 0.1631 -0.5072 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1668 -0.6926 0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9888 -1.6424 0.8023 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -0.7037 0.4887 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9706 0.3728 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5491 0.2497 0.1557 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4299 -0.0284 -0.9254 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0666 -0.1425 -2.0682 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.1505 -0.6945 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4677 -1.2262 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9531 -0.8722 -0.3104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8928 0.6594 -0.1094 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4996 1.0615 -0.2894 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4368 1.6825 0.2488 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1113 2.2783 1.3046 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3663 2.4175 -0.5388 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7748 -2.6441 0.6325 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5074 -0.6551 1.5918 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3004 -1.7184 0.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1437 0.2904 -1.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2065 0.3783 1.1089 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3465 -0.2753 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3615 -1.0803 1.1933 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2867 -2.2623 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0404 -1.1385 -1.3726 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6691 -1.3595 0.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5822 1.1778 -0.8533 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2907 0.9479 0.8792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3954 1.8570 -0.8986 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0552 3.0559 -1.2509 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 5 14 1 0 14 15 2 0 14 16 1 0 13 9 1 0 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 6 21 1 0 9 22 1 0 10 23 1 0 10 24 1 0 11 25 1 0 11 26 1 0 12 27 1 0 12 28 1 0 13 29 1 0 16 30 1 0 M END