HMDB0302695 RDKit 3D Pentadecadienoic acid 43 42 0 0 0 0 0 0 0 0999 V2000 -6.0327 1.6807 0.9613 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 1.4241 0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9237 0.0372 -0.5577 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7676 -0.1701 -1.4929 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4217 -0.0136 -0.8387 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3052 -1.0166 0.2757 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9737 -0.9448 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1869 -1.2056 0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4971 -1.1266 0.8307 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6702 -1.3908 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9336 -1.3183 0.6112 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9017 -0.4873 0.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8528 0.4807 -0.6807 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7757 1.3396 -0.9985 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0383 1.4545 -0.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3983 0.7600 0.6087 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9615 2.4301 -0.7729 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2043 2.7572 0.9684 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7809 1.3202 1.9846 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8788 1.0778 0.5975 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9045 2.1909 -0.7851 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9146 1.5862 0.5662 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9091 -0.7221 0.2459 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8964 -0.1245 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9079 0.5771 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8419 -1.1976 -1.9644 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3305 1.0315 -0.4896 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6123 -0.1581 -1.6019 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5018 -2.0212 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0769 -0.7343 1.0477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -1.7351 1.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8649 0.0231 1.5099 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2005 -0.4140 -0.7238 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0512 -2.1990 -0.3876 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5276 -1.8550 1.6507 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -0.1118 1.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5575 -2.4695 -0.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6481 -0.7818 -0.9916 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0657 -2.0364 1.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7954 -0.5718 0.9973 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9409 0.5401 -1.3026 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5715 2.0514 -1.8631 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7187 2.0436 -1.3548 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 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 3 12 13 1 0 13 14 2 3 14 15 1 0 15 16 2 0 15 17 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 6 29 1 0 6 30 1 0 7 31 1 0 7 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 11 39 1 0 12 40 1 0 13 41 1 0 14 42 1 0 17 43 1 0 M END