HMDB0256275 RDKit 3D Pentanamide 18 17 0 0 0 0 0 0 0 0999 V2000 -1.4851 1.0463 0.0105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5492 -0.3647 -0.4355 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4622 -1.2782 0.0251 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9205 -1.0074 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5633 0.2481 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4034 0.2559 0.9455 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3377 1.4386 -0.6869 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8231 1.2391 0.8766 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5408 1.3258 0.3591 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3127 1.7638 -0.8126 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5453 -0.8372 -0.1646 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5362 -0.3591 -1.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5567 -1.5061 1.1271 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7379 -2.2875 -0.4354 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9517 -1.1127 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5514 -1.9046 -0.0754 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9001 1.1008 1.2581 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9211 2.2393 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 3 5 7 1 0 1 8 1 0 1 9 1 0 1 10 1 0 2 11 1 0 2 12 1 0 3 13 1 0 3 14 1 0 4 15 1 0 4 16 1 0 6 17 1 0 7 18 1 0 M END