HMDB0036700 RDKit 3D ent-7alpha,12beta-Dihydroxy-16-kauren-19,6beta-olide 52 56 0 0 0 0 0 0 0 0999 V2000 4.7612 -1.3158 0.6243 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -0.7627 0.3605 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3005 -1.1687 0.9177 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2492 -0.5840 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0537 -0.1741 -1.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 0.3949 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8856 1.5276 0.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5557 2.6890 -0.0292 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4048 1.8459 0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5537 0.6004 0.5725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8621 0.8281 0.1712 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9902 2.2813 -0.3524 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6307 0.9732 1.5008 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0963 0.7745 1.3471 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2214 -0.6996 0.9347 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7397 -0.7747 -0.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9318 -0.3545 -1.3495 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5173 -2.2081 -0.7897 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1223 -3.1871 -0.2886 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5166 -2.2170 -1.7415 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6314 -1.1847 -1.3534 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -0.0511 -0.8054 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3064 -1.7263 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0516 -2.7373 -0.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8674 -2.1472 1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6696 -0.9321 0.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2817 -2.2644 0.9596 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1482 -0.7943 1.9555 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3874 -1.0460 -1.8258 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5668 0.6044 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0993 0.6257 -1.2403 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1693 1.3511 1.4261 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4248 3.3388 0.7172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 2.5848 1.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2158 2.2691 -0.7063 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6941 0.4755 1.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5861 3.0096 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1101 2.4497 -0.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6929 2.3580 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2382 0.1534 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 1.9152 2.0086 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 1.4311 0.6154 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5606 0.8685 2.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6272 -1.2647 1.6587 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2649 -1.0110 0.9829 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7695 0.7144 -1.5872 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9733 -0.9860 -2.2673 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8833 -0.4435 -0.8081 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0495 -0.8961 -2.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7297 0.5209 -1.7615 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1453 -2.0725 0.5945 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5465 -3.5815 -0.8383 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 10 11 1 0 11 12 1 0 11 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 20 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 6 2 1 0 22 11 1 0 10 4 1 0 22 16 1 0 23 4 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 5 29 1 0 5 30 1 0 6 31 1 0 7 32 1 0 8 33 1 0 9 34 1 0 9 35 1 0 10 36 1 0 12 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 15 44 1 0 15 45 1 0 17 46 1 0 17 47 1 0 17 48 1 0 21 49 1 0 22 50 1 0 23 51 1 0 24 52 1 0 M END