HMDB0041603 RDKit 3D Methyl 3-hydroxybutyrate 18 17 0 0 0 0 0 0 0 0999 V2000 3.1799 -0.1522 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1156 0.1910 -0.2947 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7896 -0.1118 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4917 -0.7416 0.9818 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 0.3329 -1.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6151 -0.0617 -0.6732 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0428 0.5223 0.6376 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8022 -1.4210 -0.6331 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8262 -0.9333 0.0548 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8851 -0.5083 1.5333 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 0.7250 0.6878 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1427 1.4392 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0916 -0.1072 -2.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2922 0.3467 -1.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 1.0575 0.5674 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2947 1.2619 0.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1889 -0.2520 1.4361 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6418 -1.5874 -0.1191 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 1 9 1 0 1 10 1 0 1 11 1 0 5 12 1 0 5 13 1 0 6 14 1 0 7 15 1 0 7 16 1 0 7 17 1 0 8 18 1 0 M END