HMDB0062555 RDKit 3D hydroxyisovaleroyl carnitine 41 40 0 0 0 0 0 0 0 0999 V2000 4.3563 1.5350 -0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2631 0.4765 -0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8384 -0.8389 0.1639 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1763 0.9184 0.6618 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0255 0.0181 0.7456 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8129 -0.6100 1.8182 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1274 -0.2212 -0.2523 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9744 -1.0502 -0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5448 -0.9905 -1.5226 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7783 -2.4806 0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1211 -3.2003 -0.8335 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6744 -2.6552 -1.8263 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3421 -4.5621 -0.5640 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.9792 -0.4840 0.7657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4754 0.8057 0.4635 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.2760 0.8637 -0.7428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3706 1.1714 1.5763 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 1.8662 0.3824 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1739 1.3170 -0.9108 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7673 1.4831 0.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9373 2.5359 -0.3342 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8813 0.3842 -1.3222 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5169 -1.0941 1.1748 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -1.6329 -0.5754 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9655 -0.8113 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6642 0.9990 1.6832 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8537 1.9590 0.3716 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1561 -1.7364 -1.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7906 -2.9705 -0.0337 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5302 -2.6847 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5179 -0.4820 1.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8459 -1.1961 0.8336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8503 -0.0415 -0.9497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 1.1995 -1.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0122 1.6913 -0.5919 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0743 1.9270 1.1618 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9473 0.2763 1.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7853 1.6163 2.4081 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1246 2.8195 0.2767 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9404 2.0231 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8616 1.8565 -0.4879 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 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 8 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 15 18 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 3 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 9 28 1 0 10 29 1 0 10 30 1 0 14 31 1 0 14 32 1 0 16 33 1 0 16 34 1 0 16 35 1 0 17 36 1 0 17 37 1 0 17 38 1 0 18 39 1 0 18 40 1 0 18 41 1 0 M CHG 2 13 -1 15 1 M END