HMDB0302994 RDKit 3D 2-Heptyl acetate 29 28 0 0 0 0 0 0 0 0999 V2000 3.9585 1.5370 -0.1338 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4996 1.3263 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0641 -0.1064 -0.1121 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5821 -0.1509 -0.4492 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0091 -1.5186 -0.1987 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4784 -1.4359 -0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1882 -2.7447 -0.3633 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0329 -0.3718 0.1524 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5459 0.7742 -0.4181 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1318 1.8982 0.3467 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5013 0.8467 -1.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0836 2.5867 0.2077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3425 0.8574 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5939 1.3881 -1.0356 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3426 1.5420 -1.4999 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9045 2.0008 0.2317 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6451 -0.8374 -0.6839 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2532 -0.2965 0.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 0.0489 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0823 0.6078 0.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4722 -2.3067 -0.7879 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0196 -1.7628 0.8925 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5156 -1.2150 -1.6644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3935 -3.5336 -0.2443 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7789 -3.0387 -1.2501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7841 -2.7319 0.5529 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 1.5868 1.3615 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0667 2.2672 -0.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4664 2.7827 0.4013 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 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 9 11 2 0 1 12 1 0 1 13 1 0 1 14 1 0 2 15 1 0 2 16 1 0 3 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 5 21 1 0 5 22 1 0 6 23 1 0 7 24 1 0 7 25 1 0 7 26 1 0 10 27 1 0 10 28 1 0 10 29 1 0 M END