HMDB0094760 RDKit 3D 5-hydroxyoct-2-enoylglycine 32 31 0 0 0 0 0 0 0 0999 V2000 -2.6557 1.9014 -0.0233 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1827 0.7905 0.8436 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4204 -0.4270 0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1617 -0.8859 -0.6639 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6188 0.0908 -1.5072 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1225 -1.2038 0.3828 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1445 -1.6850 -0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2398 -1.0102 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -1.3697 -0.5953 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5732 -2.5140 -1.3984 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5617 -0.6630 -0.3481 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 0.5068 0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7099 1.1996 0.6971 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7571 0.7700 0.1707 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 2.3357 1.4752 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5479 1.8957 -0.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 2.8575 0.4175 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0245 1.8690 -1.0652 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1457 1.1125 1.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5089 0.5667 1.6857 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1665 -0.2408 -0.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8518 -1.2493 0.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3484 -1.7948 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6254 0.1291 -1.4215 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5563 -1.9370 1.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9194 -0.2327 0.9269 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0781 -2.5758 -0.8522 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1809 -0.1198 0.5908 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8264 -2.6158 -2.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 0.1369 1.4614 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6584 1.1484 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4325 3.2141 1.1238 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 4 6 1 0 6 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 5 24 1 0 6 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