HMDB0241176 RDKit 3D Undec-3-enedioylcarnitine 56 55 0 0 0 0 0 0 0 0999 V2000 -5.5433 -0.7771 1.2014 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3013 -0.1106 1.4113 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.5560 -0.8556 2.4075 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6553 1.1623 2.0917 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5528 0.2618 0.2646 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4143 -0.6212 -0.1174 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8791 -1.9799 -0.6715 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6723 -1.7325 -1.8909 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8898 -1.4960 -1.8121 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0958 -1.7533 -3.1711 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.7303 -0.0250 -1.2557 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 0.2077 -1.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2118 -0.1106 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4181 0.8042 -2.2783 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 2.2588 -2.1133 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4537 2.5482 -0.8481 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7753 1.8502 -0.8468 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5421 2.1522 0.4418 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8712 1.4605 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7708 -0.0076 0.3777 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3225 -0.6857 -0.6023 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -2.1719 -0.6585 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4188 -2.6420 0.4938 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1615 -2.5228 0.4635 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9964 -3.2102 1.6122 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4968 -1.8791 1.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 -0.5609 2.0968 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1316 -0.3416 0.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6348 -1.9406 2.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0219 -0.5981 3.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5228 -0.4645 2.4635 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3931 0.9664 2.8709 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0115 1.8239 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 1.5233 2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1043 1.2846 0.4379 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2709 0.3985 -0.5754 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6713 -0.7901 0.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9947 -2.6260 -0.8658 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5095 -2.5313 0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 0.6390 -3.2227 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3665 0.2538 -2.3664 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2131 2.8916 -2.2012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3559 2.5782 -2.9592 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8562 2.1298 -0.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6213 3.6290 -0.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4238 2.1484 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6955 0.7472 -0.9038 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9576 1.8942 1.3295 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 3.2385 0.4472 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3866 1.7640 1.3963 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4999 1.8593 -0.3682 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2185 -0.5262 1.1592 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8665 -0.1636 -1.3705 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2304 -2.6179 -0.5869 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7722 -2.4911 -1.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8975 -2.8733 1.9394 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 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 3 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 1 26 1 0 1 27 1 0 1 28 1 0 3 29 1 0 3 30 1 0 3 31 1 0 4 32 1 0 4 33 1 0 4 34 1 0 5 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 7 39 1 0 14 40 1 0 14 41 1 0 15 42 1 0 15 43 1 0 16 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 21 53 1 0 22 54 1 0 22 55 1 0 25 56 1 0 M CHG 2 2 1 10 -1 M END