HMDB0094756 RDKit 3D 4-hydroxyoct-5-enoylglycine 32 31 0 0 0 0 0 0 0 0999 V2000 4.1136 -0.2511 -1.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9225 0.5712 -0.2414 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4963 0.5361 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -0.1595 -0.5922 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1972 -0.1954 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5408 -0.9378 -1.1247 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1589 -0.9080 1.1348 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2708 -0.9902 1.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7725 0.3926 1.7682 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1084 1.3173 2.6051 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8008 0.7724 1.1519 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6626 0.0870 0.2603 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4339 0.5241 -1.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5608 1.3984 -1.3701 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1679 -0.0229 -2.1873 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5376 0.2141 -2.3077 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8685 -1.3088 -1.3476 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2138 -0.2249 -1.7406 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1508 1.6553 -0.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5528 0.2109 0.5976 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1323 1.0712 1.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9309 -0.7087 -1.4707 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1892 0.8210 -0.1043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3355 -0.6131 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7548 -0.2760 1.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6335 -1.8872 1.1231 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8489 -1.5898 0.9091 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -1.5393 2.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8389 2.2093 2.1619 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7168 0.4300 0.5092 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6822 -1.0075 0.3296 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1437 -0.2941 -1.9991 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 3 4 5 1 0 5 6 1 0 5 7 1 0 7 8 1 0 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 4 22 1 0 5 23 1 0 6 24 1 0 7 25 1 0 7 26 1 0 8 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