HMDB0094773 RDKit 3D 7-hydroxyoct-1-enoylglycine 32 31 0 0 0 0 0 0 0 0999 V2000 4.2723 -0.1006 -0.0299 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0816 0.7097 -0.5151 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5749 1.6023 -1.4654 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0373 -0.1575 -1.1574 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4945 -1.2021 -0.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8548 -0.5880 1.0032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2875 0.3153 0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4585 -0.2672 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5302 -1.5372 -0.1401 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7043 -2.7655 0.0136 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5819 0.5156 -0.3273 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9002 0.1127 0.0953 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 1.0279 -0.4172 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5934 2.0017 -1.1257 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2844 0.8430 -0.1424 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 -1.1578 -0.3965 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2406 0.3741 -0.3038 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2525 -0.1593 1.0786 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6595 1.3268 0.3016 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5537 1.6291 -1.4945 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2004 0.4940 -1.4572 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4565 -0.6424 -2.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2926 -1.8945 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7708 -1.8382 -0.7402 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6596 0.0175 1.5008 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5765 -1.4144 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0435 1.1790 0.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6565 0.7245 1.7296 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4028 1.3472 -0.9182 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1342 -0.9324 -0.1884 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9207 0.2089 1.2097 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8298 0.2278 -0.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 2 0 8 11 1 0 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 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 7 28 1 0 11 29 1 0 12 30 1 0 12 31 1 0 15 32 1 0 M END