HMDB0041838 RDKit 3D beta-Zearalenol 47 48 0 0 0 0 0 0 0 0999 V2000 -1.0314 3.3199 -1.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8814 1.8786 -1.0111 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4139 1.9322 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8534 1.6598 0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4375 0.4698 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0759 -0.8580 0.4937 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1107 -0.6449 1.4773 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5463 -1.8553 -0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -1.4822 -0.7831 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1389 -2.5937 -0.8245 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0259 -2.3282 -1.6545 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1499 -1.6775 -1.4075 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6551 -0.9732 -0.2416 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5468 -1.7315 0.5533 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1218 -1.2346 1.6926 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0028 -2.0019 2.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8606 0.0310 2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9969 0.8137 1.3707 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7847 2.0842 1.8697 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3783 0.3386 0.1804 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6027 1.3449 -0.5551 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3956 2.4079 -0.7323 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3528 1.3660 -1.0315 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5919 4.0006 -0.8045 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0749 3.5297 -1.8024 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4284 3.3820 -2.4659 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5918 1.2414 -1.5922 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2404 2.9854 0.7624 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.3192 1.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0251 1.5134 1.6709 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4882 2.5369 0.3124 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5605 0.5663 0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3822 0.4445 -1.2045 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9165 -1.3805 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5133 -0.6888 2.4017 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5753 -2.8415 -0.0721 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1081 -1.7506 -1.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7364 -0.8007 0.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0453 -0.9698 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0906 -2.8680 0.2307 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7085 -3.4993 -1.1979 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9262 -2.7468 -2.6903 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9275 -1.7559 -2.2537 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8614 -2.7342 0.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2202 -2.9399 2.1893 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3087 0.4524 3.0323 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1847 2.7386 1.4596 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 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 1 0 15 17 2 0 17 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 23 2 1 0 20 13 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 6 3 28 1 0 3 29 1 0 4 30 1 0 4 31 1 0 5 32 1 0 5 33 1 0 6 34 1 1 7 35 1 0 8 36 1 0 8 37 1 0 9 38 1 0 9 39 1 0 10 40 1 0 10 41 1 0 11 42 1 0 12 43 1 0 14 44 1 0 16 45 1 0 17 46 1 0 19 47 1 0 M END