HMDB0241805 RDKit 3D 11-(3,4-dimethyl-5-propylfuran-2-yl)undecanoylcarnitine 80 80 0 0 0 0 0 0 0 0999 V2000 8.1268 -2.4312 2.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2231 -1.0466 3.0508 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3056 0.0088 1.9496 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0448 -0.1283 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8878 -0.6573 -0.0171 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6144 -0.6028 -0.4422 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2243 -1.1482 -1.7509 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2875 -0.1293 -2.8328 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3276 0.9971 -2.6701 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8767 0.5566 -2.7335 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0138 1.7827 -2.5688 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5649 1.3829 -2.6382 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1518 0.4172 -1.5822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 0.0545 -1.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2306 1.2362 -1.5606 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6835 0.9561 -1.6714 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 0.0216 -0.6589 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4908 -0.4560 0.2163 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5584 -0.3274 -0.6857 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1892 -1.2071 0.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5565 -2.4388 -0.6236 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2282 -3.4847 0.1382 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4604 -3.4709 0.3655 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4891 -4.5459 0.6391 O 0 0 0 0 0 1 0 0 0 0 0 0 -7.4686 -0.6610 0.7508 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3926 0.5662 1.4713 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.7809 0.9967 1.7364 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7908 0.4249 2.7838 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7752 1.6417 0.7628 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8885 0.0133 0.5257 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4322 0.3003 0.6302 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8117 0.3187 1.5401 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4729 1.0088 2.8123 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 -3.1638 3.2845 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -2.5767 1.7837 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1571 -2.5714 1.9673 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 -0.9811 3.7534 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 -0.8955 3.6547 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1844 -0.1943 1.3242 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2912 0.9830 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1716 -1.5243 -1.6727 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 -2.0586 -1.9993 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3222 0.3341 -2.8757 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1099 -0.6523 -3.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 1.7528 -3.4994 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 1.5336 -1.7473 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6203 -0.2610 -2.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7158 0.1269 -3.7802 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1783 2.4872 -3.4276 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 2.3659 -1.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 2.3100 -2.6532 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 0.9201 -3.6576 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6821 -0.5660 -1.7477 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 0.7552 -0.5713 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4978 -0.7128 -0.9238 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4569 -0.4188 -2.7064 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9961 2.0416 -2.2916 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0544 1.7040 -0.5602 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 1.9268 -1.4931 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 0.6505 -2.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4913 -1.5962 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2290 -2.0564 -1.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6592 -2.8208 -1.1557 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0427 -1.4163 1.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1414 -0.4766 -0.1373 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2234 1.4747 0.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7989 1.6396 2.6287 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3395 0.0685 1.9694 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1477 1.2997 3.3893 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7027 0.4420 2.7928 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2306 -0.4663 3.3133 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8509 1.5606 -0.3288 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2612 2.6365 1.0051 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7038 1.7978 1.0695 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9003 -0.5612 0.2117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 0.3261 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2126 1.2416 0.1531 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7597 1.8340 2.5878 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 1.4817 3.2048 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0717 0.3269 3.5816 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 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 20 25 1 0 25 26 1 0 26 27 1 0 26 28 1 0 26 29 1 0 6 30 2 0 30 31 1 0 30 32 1 0 32 33 1 0 32 4 2 0 1 34 1 0 1 35 1 0 1 36 1 0 2 37 1 0 2 38 1 0 3 39 1 0 3 40 1 0 7 41 1 0 7 42 1 0 8 43 1 0 8 44 1 0 9 45 1 0 9 46 1 0 10 47 1 0 10 48 1 0 11 49 1 0 11 50 1 0 12 51 1 0 12 52 1 0 13 53 1 0 13 54 1 0 14 55 1 0 14 56 1 0 15 57 1 0 15 58 1 0 16 59 1 0 16 60 1 0 20 61 1 0 21 62 1 0 21 63 1 0 25 64 1 0 25 65 1 0 27 66 1 0 27 67 1 0 27 68 1 0 28 69 1 0 28 70 1 0 28 71 1 0 29 72 1 0 29 73 1 0 29 74 1 0 31 75 1 0 31 76 1 0 31 77 1 0 33 78 1 0 33 79 1 0 33 80 1 0 M CHG 2 24 -1 26 1 M END