HMDB0034099 RDKit 3D (2E,4E)-2,7-Dimethyl-2,4-octadienedioic acid 28 27 0 0 0 0 0 0 0 0999 V2000 -3.3998 1.3693 -0.3072 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2251 0.0325 0.2772 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0169 -0.4280 0.5545 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8309 0.3722 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3925 -0.0456 0.5503 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6178 0.7253 0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 0.0651 -0.6393 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9938 -1.2813 -0.0702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7978 0.8862 -0.7495 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8929 1.9539 -0.0956 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8762 0.5364 -1.5523 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4095 -0.7744 0.5432 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5694 -0.3944 0.3035 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2332 -2.0352 1.0939 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7709 2.1531 0.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2123 1.2943 -1.4031 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4484 1.6865 -0.1824 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9518 -1.4184 0.9834 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9263 1.3518 -0.1367 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4967 -1.0316 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1559 0.8382 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4098 1.7669 -0.0286 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1442 -0.1305 -1.6387 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -2.0140 -0.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8057 -1.6998 -0.7222 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4037 -1.1606 0.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7815 0.2665 -1.1679 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5169 -2.8218 0.5029 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 9 11 1 0 2 12 1 0 12 13 2 0 12 14 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 4 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 11 27 1 0 14 28 1 0 M END