HMDB0012150 RDKit 3D 2-Keto-6-acetamidocaproate 26 25 0 0 0 0 0 0 0 0999 V2000 5.1519 -0.3710 -0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7639 -0.8023 -0.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6439 -1.9302 0.3363 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6294 0.0107 -0.4402 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3406 -0.4675 -0.0647 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2264 0.5014 -0.3795 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -0.1292 0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2686 0.7023 -0.1736 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4558 -0.0455 0.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3387 -1.1872 0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 0.5370 0.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 1.6756 -0.3041 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9066 -0.1328 0.6492 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8569 -0.8113 0.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4115 -0.8077 -1.5638 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1644 0.7331 -0.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8004 0.9443 -0.8927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.6309 1.0491 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1029 -1.4172 -0.5903 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1476 0.6396 -1.4971 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4077 1.4960 0.0595 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.3457 1.1728 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -1.1188 -0.4186 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3729 1.0079 -1.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1844 1.6153 0.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4925 0.3341 1.3324 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 11 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 4 17 1 0 5 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 13 26 1 0 M END