HMDB0241456 RDKit 3D Pentadeca-3,5,7-trienedioylcarnitine 64 63 0 0 0 0 0 0 0 0999 V2000 7.5624 1.3479 1.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7079 0.0549 0.8469 N 0 0 0 0 0 4 0 0 0 0 0 0 8.6537 0.2051 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4757 -0.7591 1.8254 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5393 -0.6462 0.4665 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3254 0.1327 0.0792 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6678 1.0139 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5438 1.8497 -1.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4285 1.8191 -1.0756 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7826 2.7125 -2.6550 O 0 0 0 0 0 1 0 0 0 0 0 0 4.3290 -0.8219 -0.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1395 -0.8451 0.4285 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9424 -0.0045 1.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0501 -1.8333 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4985 -1.4347 -1.1794 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -1.0724 -1.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7689 -0.9923 -0.4856 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.6105 -0.8178 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0387 -0.5333 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2769 -0.1691 -0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7749 0.2270 -1.3858 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9018 -0.6486 -1.8155 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0506 -0.5817 -0.8579 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5683 0.8142 -0.7656 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7517 0.9231 0.1468 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4202 0.4976 1.5493 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6183 0.6582 2.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5759 0.3397 3.5986 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7815 1.1601 1.8613 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1056 1.3504 2.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1154 2.1637 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 1.6605 1.6819 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6299 -0.2734 -0.0743 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7701 1.2654 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2271 -0.3401 -1.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8303 -0.8730 2.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3536 -0.1659 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7700 -1.7131 1.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2996 -1.3776 1.2986 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8509 -1.3409 -0.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9294 0.7776 0.8773 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 0.4417 -1.9252 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4372 1.7314 -0.7446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2753 -1.8248 0.8941 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4769 -2.8501 0.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2361 -1.4610 -2.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0171 -0.7995 -2.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6143 -1.2417 0.5694 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1503 -0.3687 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7723 -0.8117 1.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9882 -0.1525 0.8045 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0898 1.2900 -1.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9534 0.1922 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6192 -1.7173 -1.9034 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2072 -0.3532 -2.8525 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8665 -1.3064 -1.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7373 -0.9434 0.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8645 1.2228 -1.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7644 1.5030 -0.4085 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6107 0.2907 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1696 1.9615 0.1283 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1046 -0.5838 1.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5580 1.1077 1.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3461 0.7368 1.1541 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 2 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 6 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 2 3 16 17 1 0 17 18 2 3 18 19 1 0 19 20 2 3 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 1 30 1 0 1 31 1 0 1 32 1 0 3 33 1 0 3 34 1 0 3 35 1 0 4 36 1 0 4 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 7 42 1 0 7 43 1 0 14 44 1 0 14 45 1 0 15 46 1 0 16 47 1 0 17 48 1 0 18 49 1 0 19 50 1 0 20 51 1 0 21 52 1 0 21 53 1 0 22 54 1 0 22 55 1 0 23 56 1 0 23 57 1 0 24 58 1 0 24 59 1 0 25 60 1 0 25 61 1 0 26 62 1 0 26 63 1 0 29 64 1 0 M CHG 2 2 1 10 -1 M END