HMDB0240770 RDKit 3D 3-Hydroxypalmitoleoylcarnitine 72 71 0 0 0 0 0 0 0 0999 V2000 10.0945 1.1834 -0.3738 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0199 1.9345 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1199 0.9205 1.0828 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4822 0.0012 0.0714 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5878 -1.0218 0.6729 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -0.4307 1.4546 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5662 0.4066 0.6293 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2657 0.2358 0.3742 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -0.9231 0.9762 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9762 -1.7773 -0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7701 -1.4818 -0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3931 -0.2409 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 0.8645 -0.5763 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2102 0.4421 0.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5606 1.5281 1.1008 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3407 0.0270 -0.6038 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5147 -0.3685 0.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4731 -0.3330 1.5091 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6599 -0.7791 -0.3888 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8223 -1.1735 0.2938 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -2.6419 0.0606 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1699 -3.0144 -1.3628 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1299 -2.1838 -2.2976 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3667 -4.3479 -1.6728 O 0 0 0 0 0 1 0 0 0 0 0 0 -7.0118 -0.3573 -0.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8943 1.0503 0.1721 N 0 0 0 0 0 4 0 0 0 0 0 0 -8.1932 1.6371 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7431 1.3234 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8781 1.7252 -0.5715 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0148 1.8222 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7972 1.0101 -1.4464 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2849 0.1926 0.0482 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4478 2.5248 -0.3667 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4413 2.6193 1.1311 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7918 0.3251 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3899 1.4182 1.7379 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9280 0.5710 -0.7072 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2888 -0.5367 -0.4677 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1288 -1.6022 -0.1568 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1487 -1.7587 1.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8193 0.2453 2.2718 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -1.2666 1.9971 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0188 1.2980 0.1428 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7653 0.9269 -0.2807 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7368 -0.5576 1.6581 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1856 -1.5546 1.6198 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8229 -2.0941 -0.8089 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7971 -2.8109 0.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6376 -2.3166 -1.6483 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1116 -1.8206 -0.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2254 0.1239 -2.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4455 -0.3861 -2.2312 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4258 1.7016 -1.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7118 1.3604 0.0391 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9443 -0.3728 0.9512 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 1.8307 1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0259 -0.8674 -1.2101 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6238 0.8316 -1.2945 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5962 -1.0678 1.3854 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8628 -3.0599 0.6447 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1058 -3.1569 0.4374 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3135 -0.5728 -1.1188 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8744 -0.7193 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0876 2.0210 -1.2323 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4050 2.5215 0.4454 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9893 0.8672 -0.1324 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4554 0.6691 2.1359 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7142 1.1918 1.9391 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0865 2.3905 1.7218 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3067 2.6430 -1.0163 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5029 1.1276 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0348 2.0836 0.0641 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 2 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 14 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 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 4 38 1 0 5 39 1 0 5 40 1 0 6 41 1 0 6 42 1 0 7 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 15 56 1 0 16 57 1 0 16 58 1 0 20 59 1 0 21 60 1 0 21 61 1 0 25 62 1 0 25 63 1 0 27 64 1 0 27 65 1 0 27 66 1 0 28 67 1 0 28 68 1 0 28 69 1 0 29 70 1 0 29 71 1 0 29 72 1 0 M CHG 2 24 -1 26 1 M END