HMDB0094744 RDKit 3D 2-hydroxyoct-7-enoylglycine 32 31 0 0 0 0 0 0 0 0999 V2000 4.9318 0.7367 0.4595 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0767 1.6756 0.1231 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 1.3990 -0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3297 -0.0758 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8698 -0.2572 -0.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4539 -1.7150 -0.3335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -1.7534 -0.6995 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2134 -1.2588 -1.9881 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7772 -0.8687 0.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7017 -1.1808 1.5856 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4521 0.1294 -0.1779 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1942 1.0335 0.6341 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6021 0.5853 0.7059 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4124 1.2542 1.3763 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9721 -0.5612 0.0263 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9484 0.9884 0.6796 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6131 -0.2865 0.5146 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4174 2.7096 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4763 1.7107 -1.2439 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9524 1.9282 0.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9863 -0.6773 -0.7576 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5199 -0.4545 0.9399 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2913 0.2851 0.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6575 0.0789 -1.4432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5679 -2.0564 0.7123 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 -2.3655 -0.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4207 -2.7964 -0.6973 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2976 -0.2604 -1.9559 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7809 -0.4805 2.3111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7676 1.1809 1.6476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2303 2.0724 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9212 -0.7196 -0.2524 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 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 2 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 4 22 1 0 5 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