HMDB0255934 RDKit 3D 16-(Acetyloxy)-3,14-dihydroxycard-20(22)-enolide 67 71 0 0 0 0 0 0 0 0999 V2000 -6.0263 2.2682 -2.1481 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7508 2.2573 -1.4067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3029 3.3656 -0.9679 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9997 1.1402 -1.1484 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8097 1.0972 -0.4619 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6762 0.6791 -1.4296 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6245 0.4408 -0.3816 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4456 1.6416 0.2992 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6847 -0.0380 -0.8885 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3516 1.1060 -1.5499 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8341 0.9474 -1.7455 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3973 0.7337 -0.3343 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8757 0.8522 -0.3776 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 0.6211 1.0072 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4024 -0.3818 0.8983 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3502 0.1120 1.9549 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7072 -1.0843 1.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9028 -0.6364 0.0792 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2106 -1.5627 -1.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4338 -0.6601 0.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9512 -0.1578 1.5987 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5063 -0.4826 1.8218 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3211 -0.5061 0.5644 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4212 -1.8976 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6808 0.1864 0.7083 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7674 -0.7619 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8379 -1.0401 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6266 -2.1310 0.7851 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7224 -2.6219 0.3508 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9317 -2.4997 1.9092 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8074 -1.7026 2.0452 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8616 2.3552 -1.4034 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1508 1.3801 -2.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0715 3.1742 -2.7835 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5952 2.1745 -0.1641 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3917 1.5621 -2.0381 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9528 -0.2022 -2.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5951 2.4475 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5053 -0.8118 -1.6933 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2025 2.0903 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9092 1.2222 -2.5775 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1225 0.1560 -2.4352 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2217 1.9085 -2.1452 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9889 1.5442 0.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1153 1.9126 -0.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3794 0.2380 -1.1423 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9369 1.5023 1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4638 -0.7469 -0.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8771 -0.3110 2.8358 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6256 0.8878 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2107 -1.7655 1.9386 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -1.6614 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3695 -1.6312 -1.8042 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1785 -1.3540 -1.5604 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3008 -2.5851 -0.6383 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1468 -1.7573 0.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5096 -0.7338 2.3732 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 0.9051 1.7801 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6182 -1.4828 2.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8869 0.2597 2.5628 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -2.6717 0.7411 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -2.2352 -0.1605 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9138 -2.0493 -0.9299 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5415 0.8387 1.6125 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 -0.5909 -0.7355 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0073 -1.0138 2.9177 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8751 -2.2391 2.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 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 12 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 28 30 1 0 30 31 1 0 25 5 1 0 31 26 1 0 23 7 1 0 20 9 1 0 18 12 1 0 1 32 1 0 1 33 1 0 1 34 1 0 5 35 1 0 6 36 1 0 6 37 1 0 8 38 1 0 9 39 1 0 10 40 1 0 10 41 1 0 11 42 1 0 11 43 1 0 12 44 1 0 13 45 1 0 13 46 1 0 14 47 1 0 15 48 1 0 16 49 1 0 16 50 1 0 17 51 1 0 17 52 1 0 19 53 1 0 19 54 1 0 19 55 1 0 20 56 1 0 21 57 1 0 21 58 1 0 22 59 1 0 22 60 1 0 24 61 1 0 24 62 1 0 24 63 1 0 25 64 1 0 27 65 1 0 31 66 1 0 31 67 1 0 M END