HMDB0035919 RDKit 3D Corchorifatty acid F 55 54 0 0 0 0 0 0 0 0999 V2000 7.0925 0.2141 2.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 0.4305 0.7229 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8231 -0.6116 0.3004 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6104 -0.4422 -0.1751 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0039 0.8642 -0.3549 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6238 1.1585 -1.7936 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0511 2.4342 -1.8542 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6946 0.1296 -2.3663 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4645 0.4975 -3.7048 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4412 -0.0377 -1.6203 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2643 -0.1700 -2.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -0.3414 -1.4345 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6647 -1.5089 -1.8864 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7735 -0.3093 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9728 -0.4507 0.9019 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7478 -1.7066 0.7726 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9063 -1.7273 1.7441 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8789 -0.6013 1.5338 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4562 -0.6569 0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4466 0.4433 -0.1172 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9102 1.7993 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7548 2.1302 0.3099 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8158 2.8455 -0.2213 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7597 1.0683 2.4774 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1764 0.2589 2.8259 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6543 -0.7203 2.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7490 0.1952 0.2139 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4636 1.4557 0.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2046 -1.6565 0.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0388 -1.3302 -0.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0497 0.9679 0.2538 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6345 1.6873 -0.0176 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5166 1.1968 -2.4511 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3584 2.5360 -1.1553 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2667 -0.8378 -2.4149 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9261 1.3407 -3.6494 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4733 -0.0548 -0.5366 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2377 -0.1523 -3.2914 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6688 0.5063 -1.7307 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0449 -2.2290 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0585 -1.1390 0.2625 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2566 0.6416 0.2908 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6289 -0.3830 1.9721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6631 0.4187 0.7635 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -1.9310 -0.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0655 -2.5554 1.0086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4317 -1.6285 2.7643 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4017 -2.7213 1.7634 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7092 -0.7798 2.2937 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3673 0.3494 1.7751 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6624 -0.6758 -0.6037 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0094 -1.6155 0.0659 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7616 0.3253 -1.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3803 0.3233 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7655 2.7557 0.1072 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 4 30 1 0 5 31 1 0 5 32 1 0 6 33 1 0 7 34 1 0 8 35 1 0 9 36 1 0 10 37 1 0 11 38 1 0 12 39 1 0 13 40 1 0 14 41 1 0 14 42 1 0 15 43 1 0 15 44 1 0 16 45 1 0 16 46 1 0 17 47 1 0 17 48 1 0 18 49 1 0 18 50 1 0 19 51 1 0 19 52 1 0 20 53 1 0 20 54 1 0 23 55 1 0 M END