HMDB0241236 RDKit 3D 3-Hydroxydodec-8-enedioylcarnitine 60 59 0 0 0 0 0 0 0 0999 V2000 -6.0311 2.3870 0.3213 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9643 1.0151 -0.2956 N 0 0 0 0 0 4 0 0 0 0 0 0 -6.9979 0.2646 0.2835 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2885 1.2985 -1.6847 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6369 0.5814 -0.2409 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2201 -0.8115 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6162 -1.8147 -1.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0006 -2.1151 -1.3888 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7289 -1.7455 -2.3363 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6787 -2.9383 -0.4594 O 0 0 0 0 0 1 0 0 0 0 0 0 -2.7560 -0.8181 -0.0369 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -1.1861 1.0868 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -1.5340 2.0875 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5881 -1.1961 1.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0166 -0.7493 -0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4282 -1.6638 -1.0992 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4991 -0.7487 -0.1381 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1066 0.1569 0.8977 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6074 0.1445 0.8634 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1704 0.5929 -0.4603 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6566 0.5626 -0.4435 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3675 0.1921 0.5997 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8464 0.1782 0.5679 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3615 0.6271 -0.7649 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8333 0.6001 -0.7601 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4629 0.9414 -1.7792 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5169 0.2006 0.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7185 2.3487 1.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3832 2.9967 -0.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0876 2.6880 0.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5947 0.9295 0.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7649 -0.0783 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7063 -0.5834 0.9233 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3042 0.9008 -1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3422 2.3729 -1.9136 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6127 0.7506 -2.3788 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0475 1.0709 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1649 1.1263 0.6527 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4962 -1.1651 0.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1645 -1.5400 -2.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0164 -2.7580 -0.9057 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3248 -0.5169 2.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2087 -2.2255 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4358 0.2260 -0.3823 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2196 -2.4250 -1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8043 -0.3298 -1.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9074 -1.7574 0.0244 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8021 -0.2012 1.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7421 1.1832 0.6895 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9883 0.8135 1.6598 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0219 -0.8643 1.0666 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8014 0.0307 -1.3139 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8773 1.6620 -0.6298 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1333 0.8779 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8593 -0.1089 1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2027 0.8341 1.4077 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2153 -0.8435 0.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9271 -0.0688 -1.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9640 1.6532 -0.9597 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2234 0.5793 1.2600 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 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 2 3 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 1 28 1 0 1 29 1 0 1 30 1 0 3 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 6 39 1 0 7 40 1 0 7 41 1 0 14 42 1 0 14 43 1 0 15 44 1 0 16 45 1 0 17 46 1 0 17 47 1 0 18 48 1 0 18 49 1 0 19 50 1 0 19 51 1 0 20 52 1 0 20 53 1 0 21 54 1 0 22 55 1 0 23 56 1 0 23 57 1 0 24 58 1 0 24 59 1 0 27 60 1 0 M CHG 2 2 1 10 -1 M END