HMDB0033676 RDKit 3D (±)-3-Methyl-1-pentanol 21 20 0 0 0 0 0 0 0 0999 V2000 2.3509 -0.1908 0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9126 -0.4612 0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0165 0.3743 -0.3245 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4195 1.8367 -0.1048 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 0.2846 -0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0629 -1.0576 -0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5395 -2.0412 0.6267 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4001 0.8375 -0.3758 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0624 -0.2785 0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5757 -0.9120 -0.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8968 -0.0898 1.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7164 -1.5294 0.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1865 0.1565 -1.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4572 2.4857 0.0951 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0171 2.2113 -0.9759 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0873 1.9387 0.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 0.6855 0.9581 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 0.9737 -0.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0741 -1.4241 -1.2447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1457 -0.9644 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2773 -2.8354 0.0892 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 3 5 1 0 5 6 1 0 6 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 4 14 1 0 4 15 1 0 4 16 1 0 5 17 1 0 5 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 M END