HMDB0013129 RDKit 3D Glutaconylcarnitine 38 37 0 0 0 0 0 0 0 0999 V2000 -2.9531 1.5166 -1.3351 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4597 0.6619 -0.2412 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.6247 0.3639 0.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5563 1.4575 0.5263 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8908 -0.4990 -0.8489 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -1.2416 -0.0261 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4646 -1.9826 1.1503 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4409 -3.0046 0.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -3.6509 1.6794 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7777 -3.3543 -0.5341 O 0 0 0 0 0 1 0 0 0 0 0 0 0.2229 -0.4680 0.3366 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4953 -0.7641 -0.1194 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6067 -1.7721 -0.8863 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6731 0.0447 0.2605 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8487 -0.2646 -0.1851 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1387 0.3953 0.0642 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1438 1.5565 0.9201 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1747 2.0778 1.4753 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3887 2.1753 1.1579 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5409 0.8514 -2.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5649 2.3582 -0.9374 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0775 1.8796 -1.8923 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0520 -0.6287 0.3625 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4596 1.0949 0.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3867 0.4874 1.6632 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1203 2.3928 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3022 0.9914 1.5194 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6708 1.8076 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6743 -1.1613 -1.1977 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3435 -0.1589 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -2.0559 -0.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5944 -2.5344 1.6132 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8241 -1.3097 1.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4841 0.8674 0.9032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8504 -1.1693 -0.8538 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8422 -0.4034 0.4499 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6011 0.6158 -0.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7674 2.8273 0.5005 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 2 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 4 28 1 0 5 29 1 0 5 30 1 0 6 31 1 6 7 32 1 0 7 33 1 0 14 34 1 0 15 35 1 0 16 36 1 0 16 37 1 0 19 38 1 0 M CHG 2 2 1 10 -1 M END