HMDB0041614 RDKit 3D Dipropyl hexanedioate 38 37 0 0 0 0 0 0 0 0999 V2000 -6.6184 0.6347 0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1079 -0.8031 0.0166 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1219 -1.0596 1.1335 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0181 -0.2169 1.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1099 -0.1057 0.0769 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2508 -0.8247 -0.9446 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9417 0.8149 0.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7113 -0.0702 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5546 0.7619 -0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7171 -0.1912 -0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9547 0.6204 -0.3186 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9255 1.8722 -0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2219 0.0579 -0.4253 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3997 0.8325 -0.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5587 -0.1386 -0.5428 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4836 -1.0608 0.6642 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 1.2682 -0.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2447 0.8169 -0.7673 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1161 0.7987 1.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6983 -0.9467 -0.9808 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9740 -1.4475 0.2062 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6364 -0.9346 2.0819 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -2.1459 1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8573 1.4194 0.9899 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9941 1.4620 -0.8206 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7065 -0.8231 0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7478 -0.5807 -1.1163 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5443 1.5362 -0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5863 1.2888 0.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7336 -0.9539 0.5198 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -0.7435 -1.2469 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4437 1.5404 -1.2783 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 1.4470 0.5028 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3465 -0.7364 -1.4726 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5329 0.3875 -0.6077 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 -0.5672 1.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8469 -2.0808 0.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4151 -1.1284 0.9777 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 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 1 17 1 0 1 18 1 0 1 19 1 0 2 20 1 0 2 21 1 0 3 22 1 0 3 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 14 32 1 0 14 33 1 0 15 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 16 38 1 0 M END