HMDB0252748 RDKit 3D Glisentide 58 60 0 0 0 0 0 0 0 0999 V2000 3.9893 3.9832 0.6187 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 2.7315 0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4052 1.9768 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 2.4621 1.6657 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2021 1.7120 2.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5105 0.4947 1.6163 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7814 0.0294 0.5668 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7088 0.7661 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0104 0.1621 -1.1018 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4052 -1.0040 -1.4906 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9411 0.7823 -1.7755 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2724 0.1160 -2.8751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6136 -1.1299 -2.3803 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6173 -0.8568 -1.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3206 -0.4958 -1.5735 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6143 -0.2481 -0.5608 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2879 -0.3535 0.7645 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3906 -0.0143 2.0792 S 0 0 0 0 0 6 0 0 0 0 0 0 -0.6779 -0.4424 3.3698 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7407 1.4367 2.1766 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8088 -0.9893 1.9781 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9182 -0.4986 1.2216 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8085 0.6214 0.6765 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1111 -1.2239 1.0714 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1906 -0.6326 0.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 -1.4887 -0.9717 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8552 -1.6787 -1.0746 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2800 -1.8299 0.3808 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4417 -0.7317 1.0409 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0308 -0.7215 1.0453 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9554 -0.9655 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7892 4.7269 0.4762 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0257 4.2894 0.1145 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7569 3.8038 1.7047 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9347 3.4138 2.1238 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7533 2.1012 2.9878 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3435 -0.0670 2.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0126 -0.9123 0.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5741 1.7166 -1.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5999 0.7852 -3.4437 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0904 -0.2097 -3.5621 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3521 -1.8319 -1.9814 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -1.6397 -3.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0147 -0.3991 -2.6102 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6321 0.0304 -0.8301 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8554 -1.9077 2.4513 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 -2.1377 1.5125 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9094 0.3894 -0.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9358 -0.9798 -1.8725 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8543 -2.4596 -0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0936 -2.5703 -1.6896 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3325 -0.7605 -1.4435 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9167 -2.8230 0.6968 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3347 -1.6170 0.5549 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2688 -1.0695 2.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0009 0.2237 1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3143 -0.8099 2.0859 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9731 -1.2550 0.2681 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 2 0 18 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 17 30 1 0 30 31 2 0 8 3 1 0 31 14 1 0 29 25 1 0 1 32 1 0 1 33 1 0 1 34 1 0 4 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 11 39 1 0 12 40 1 0 12 41 1 0 13 42 1 0 13 43 1 0 15 44 1 0 16 45 1 0 21 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 26 50 1 0 27 51 1 0 27 52 1 0 28 53 1 0 28 54 1 0 29 55 1 0 29 56 1 0 30 57 1 0 31 58 1 0 M END