HMDB0241743 RDKit 3D 4-Hydroxyoctanoylcarnitine 50 49 0 0 0 0 0 0 0 0999 V2000 5.3379 2.3211 -0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5614 1.2538 0.6034 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5167 0.1720 0.5017 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5906 -0.4443 -0.8803 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5669 -1.5428 -1.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7456 -2.0270 -2.3727 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1711 -0.9688 -1.0277 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1157 -2.0233 -1.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2273 -1.4026 -1.1631 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7119 -0.8617 -2.1769 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0513 -1.3486 -0.0834 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3653 -0.7284 -0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2404 -1.9360 0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6604 -1.8551 0.0754 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3644 -1.8766 1.1115 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -1.7422 -1.1212 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.4694 0.3581 0.8468 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6077 1.1933 0.9671 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.1695 2.6107 1.1908 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3388 0.8703 2.1766 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5109 1.1709 -0.1416 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2649 2.5607 -0.5601 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8182 3.2783 -0.0591 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8475 2.0834 -1.3953 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5417 1.7231 1.6145 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5795 0.8305 0.4703 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5225 0.6765 0.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6814 -0.6016 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6099 -0.9184 -0.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4173 0.3023 -1.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7263 -2.3525 -0.3268 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -2.9275 -2.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0255 -0.5485 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1067 -0.1767 -1.7892 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2086 -2.7292 -0.3472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2231 -2.5812 -2.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4738 -0.3648 -1.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9431 -2.7227 -0.7298 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8826 -2.4825 1.0107 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3488 -0.1215 1.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5671 1.0416 0.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8995 3.0903 0.2456 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0761 3.1113 1.5824 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4039 2.6067 1.9602 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 0.7283 1.9642 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9082 -0.0945 2.5748 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1453 1.6095 2.9537 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1616 0.6990 -1.0563 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5147 0.8382 0.2191 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6965 2.2491 -0.4435 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 5 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 12 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 18 21 1 0 1 22 1 0 1 23 1 0 1 24 1 0 2 25 1 0 2 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 5 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 12 37 1 0 13 38 1 0 13 39 1 0 17 40 1 0 17 41 1 0 19 42 1 0 19 43 1 0 19 44 1 0 20 45 1 0 20 46 1 0 20 47 1 0 21 48 1 0 21 49 1 0 21 50 1 0 M CHG 2 16 -1 18 1 M END