HMDB0059744 RDKit 3D 3,4-Methyleneazelaic acid 31 30 0 0 0 0 0 0 0 0999 V2000 1.7109 -1.7133 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9413 -0.7554 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4417 -1.1083 0.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3998 -0.4702 -0.9044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8387 -0.7613 -0.5878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -0.3018 0.7448 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2102 1.1453 0.9677 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5589 1.5908 2.0914 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7664 2.0668 0.0401 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5154 0.5823 -0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8511 1.5998 0.3709 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9359 0.8286 -0.5509 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8741 0.0502 0.2923 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4217 -0.6414 1.2575 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2298 0.0228 0.0997 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7316 -1.5709 -1.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3297 -2.7200 -0.9886 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6285 -0.7986 1.1113 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5688 -2.2178 -0.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2202 -1.0256 -1.8883 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1386 0.5487 -1.1194 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4832 -0.3689 -1.3866 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9487 -1.8786 -0.6088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7806 -0.8796 1.5536 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3752 -0.5853 0.8414 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0322 2.0437 -0.9382 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3523 2.5649 0.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1694 1.5208 0.7115 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0669 0.5832 -1.6394 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1407 1.9062 -0.4331 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7655 0.7430 -0.3589 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 2 10 1 0 10 11 2 3 10 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 5 22 1 0 5 23 1 0 6 24 1 0 6 25 1 0 9 26 1 0 11 27 1 0 11 28 1 0 12 29 1 0 12 30 1 0 15 31 1 0 M END