HMDB0094757 RDKit 3D 4-hydroxyoct-6-enoylglycine 32 31 0 0 0 0 0 0 0 0999 V2000 -4.9300 1.7925 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7363 0.9511 1.2722 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 0.1586 0.3366 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -0.6912 0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9922 -0.2477 -0.4246 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4787 -0.4474 -1.7013 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2397 -1.0317 -0.1259 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3393 -0.7020 -1.0646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7111 0.7178 -0.9943 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8463 1.7003 -1.4465 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8498 1.0528 -0.5085 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 0.0235 -0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9608 0.6009 0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0821 1.8410 0.6131 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -0.2070 1.0739 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8261 1.1461 1.0941 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9387 2.6415 1.7034 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8983 2.1254 -0.0646 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 0.9902 2.2308 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7403 0.1343 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2561 -1.7679 0.5055 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6252 -0.5022 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8454 0.8554 -0.2158 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5847 0.3699 -2.2302 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5123 -0.8017 0.9419 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0141 -2.1134 -0.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -1.0000 -2.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1996 -1.3758 -0.8312 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0673 2.6849 -1.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0668 -0.5811 -0.9366 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2752 -0.6319 0.7235 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 -0.7967 0.5115 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 3 3 4 1 0 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 3 20 1 0 4 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