HMDB0061930 RDKit 3D 4-Ethoxy-4-oxobutanoic acid 20 19 0 0 0 0 0 0 0 0999 V2000 3.0530 -0.3154 0.7019 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3832 1.0324 0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3376 1.0707 -0.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2115 0.2292 -0.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2506 -0.5297 0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8756 0.2856 -1.2166 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0172 -0.6352 -0.9587 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -0.3257 0.3315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2488 -0.8637 1.3672 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7399 0.5819 0.3334 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7095 -1.0051 -0.1154 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1607 -0.1889 0.5269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9253 -0.7763 1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 1.8000 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 1.3121 1.6299 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 1.3343 -1.2942 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4068 0.1126 -2.2123 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7547 -0.5448 -1.8016 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6703 -1.6978 -0.9904 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5656 0.3955 0.8810 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 2 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 6 16 1 0 6 17 1 0 7 18 1 0 7 19 1 0 10 20 1 0 M END