HMDB0035974 RDKit 3D (S)-Spirobrassinin 26 28 0 0 0 0 0 0 0 0999 V2000 -4.9614 0.1748 -0.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8894 -0.1734 1.1027 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2891 -0.6506 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9193 -0.7402 -0.6879 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6342 -1.1271 -1.0094 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3166 -1.0206 0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -1.0931 1.5089 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2302 -2.1523 0.1317 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9103 -3.3612 0.1164 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5504 -1.6259 0.1473 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4518 -0.2080 0.1617 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4344 0.7897 0.1798 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1231 2.1300 0.1918 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7891 2.4769 0.1854 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7937 1.5239 0.1676 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1293 0.1822 0.1558 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0350 0.0547 -0.0683 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8014 1.2447 -0.6393 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6558 -0.5111 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -0.4039 -1.7886 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5376 -2.1242 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4653 -2.1672 0.1484 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4454 0.4673 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8966 2.9018 0.2059 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5666 3.5478 0.1951 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2455 1.8651 0.1634 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 1 0 6 7 1 0 6 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 7 3 1 0 16 11 1 0 16 6 1 0 1 17 1 0 1 18 1 0 1 19 1 0 5 20 1 0 5 21 1 0 10 22 1 0 12 23 1 0 13 24 1 0 14 25 1 0 15 26 1 0 M END