HMDB0094753 RDKit 3D 4-hydroxyoct-2-enoylglycine 32 31 0 0 0 0 0 0 0 0999 V2000 -4.9434 1.2578 0.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5114 0.9703 -0.4319 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3435 -0.5273 -0.3914 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -0.9602 -0.8179 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9068 -0.3519 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2245 -0.8410 1.3952 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.8843 -0.2067 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5512 -0.2066 -0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8175 -0.8279 -0.3765 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8804 -2.1368 -0.8836 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9534 -0.2359 -0.2409 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1372 1.0892 0.2526 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4478 1.3124 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6953 2.4516 1.3488 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4018 0.3325 0.9897 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3077 2.2265 -0.3257 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5978 0.4276 -0.3644 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9709 1.1553 1.1366 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8475 1.4972 0.2831 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3259 1.3980 -1.4398 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -0.8450 0.6533 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1065 -0.9722 -1.0491 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7912 -0.6951 -1.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8967 -2.0519 -0.7253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9392 0.7497 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3365 -1.8294 1.2836 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4548 -1.9125 -0.6022 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5016 0.7914 0.3504 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7684 -2.8639 -0.1674 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0549 1.7973 -0.5956 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3554 1.3230 1.0121 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0881 -0.6380 0.9648 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 5 7 1 0 7 8 2 3 8 9 1 0 9 10 1 0 9 11 2 3 11 12 1 0 12 13 1 0 13 14 2 0 13 15 1 0 1 16 1 0 1 17 1 0 1 18 1 0 2 19 1 0 2 20 1 0 3 21 1 0 3 22 1 0 4 23 1 0 4 24 1 0 5 25 1 0 6 26 1 0 7 27 1 0 8 28 1 0 10 29 1 0 12 30 1 0 12 31 1 0 15 32 1 0 M END