HMDB0304359 RDKit 3D gibberellin A15 (open lactone form) 51 54 0 0 0 0 0 0 0 0999 V2000 4.2453 1.8446 -1.2741 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2517 1.2162 -0.7182 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 1.3246 -1.0153 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0787 0.6533 0.1009 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1405 0.6992 1.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3343 0.2203 0.3695 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1743 -1.1886 -0.1056 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8582 -1.4237 -0.8547 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8154 -0.8105 -0.0566 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6164 -0.8396 -0.4597 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9168 -0.4252 -1.8341 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2213 -1.3024 -2.6977 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2094 -2.2017 -0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -2.1740 0.6621 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3024 -0.9687 0.4009 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5583 0.3438 0.6885 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0797 1.4537 -0.1775 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9449 0.6610 2.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4598 1.7758 2.3457 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7418 -0.2560 3.1286 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.1284 0.0941 0.6403 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2072 1.2859 0.4971 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0167 2.0947 1.6883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5947 3.2085 1.5148 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4467 1.7196 2.9213 O 0 0 0 0 0 1 0 0 0 0 0 0 4.0416 2.5542 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2829 1.7064 -0.9953 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6806 0.8814 -2.0169 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4498 2.3689 -1.0794 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8971 -0.0027 2.0135 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3829 1.7156 1.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2409 0.2814 0.9639 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9721 -1.3942 -0.8262 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2779 -1.8595 0.7478 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7293 -2.5365 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9487 -1.1360 -1.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8388 -1.3105 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6686 0.6070 -2.1168 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9704 -0.5673 -2.0748 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7999 -2.0478 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4681 -2.7237 -1.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4682 -2.8678 0.2955 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0584 -3.0585 0.3934 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2103 -2.3016 1.7453 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7254 -1.0226 -0.5979 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1868 -1.0832 1.0906 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4589 1.7394 -1.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 2.3936 0.4061 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0996 1.1258 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8131 -0.4055 1.5912 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5426 1.9386 -0.3625 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 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 16 18 1 0 18 19 2 0 18 20 1 0 16 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 6 2 1 0 21 10 1 0 9 4 1 0 22 4 1 0 1 26 1 0 1 27 1 0 3 28 1 0 3 29 1 0 5 30 1 0 5 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 8 36 1 0 9 37 1 0 11 38 1 0 11 39 1 0 12 40 1 0 13 41 1 0 13 42 1 0 14 43 1 0 14 44 1 0 15 45 1 0 15 46 1 0 17 47 1 0 17 48 1 0 17 49 1 0 21 50 1 0 22 51 1 0 M CHG 2 20 -1 25 -1 M END