HMDB0060656 RDKit 3D Monoethylglycinexylidide 33 33 0 0 0 0 0 0 0 0999 V2000 4.7369 -0.6037 1.5651 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0315 -0.1067 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5865 -0.1266 0.4673 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0454 0.3683 -0.7723 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5906 0.4190 -0.8157 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0152 0.8349 -1.8503 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2246 0.0141 0.2732 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6401 0.0586 0.2432 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3221 1.1715 0.6526 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5617 2.3526 1.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6935 1.2664 0.6436 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4284 0.1891 0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7876 -0.9527 -0.2214 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3914 -1.0261 -0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7452 -2.2611 -0.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6382 -1.7008 1.6722 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8202 -0.3983 1.4198 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -0.0505 2.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2728 -0.8343 -0.4877 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3666 0.8911 0.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2831 -1.1005 0.6663 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4362 -0.3080 -1.5818 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4398 1.3905 -0.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2252 -0.3318 1.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1573 2.8356 1.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 3.0936 0.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5607 2.1170 1.4977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2155 2.1652 0.9753 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4949 0.2732 0.1977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3477 -1.8029 -0.5703 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -3.1190 -0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6492 -2.3288 -1.7717 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7541 -2.3889 -0.1764 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 9 10 1 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 14 8 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 7 24 1 0 10 25 1 0 10 26 1 0 10 27 1 0 11 28 1 0 12 29 1 0 13 30 1 0 15 31 1 0 15 32 1 0 15 33 1 0 M END