HMDB0041054 RDKit 3D Ustiloxin D 69 70 0 0 0 0 0 0 0 0999 V2000 3.3937 -3.6151 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1711 -2.1840 -0.5325 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0938 -1.5780 0.3128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6525 -1.5988 1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0025 -2.4030 0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3709 -2.3686 0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2035 -1.7291 -0.6339 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5512 -1.8296 -0.4641 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0661 -2.5767 0.6248 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2844 -3.2200 1.5408 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9307 -3.0917 1.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1496 -3.7760 2.3027 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6805 -1.2146 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6684 -1.4744 -2.6271 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 0.2545 -1.0858 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1218 0.7399 -1.3326 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0875 0.2540 -0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3457 0.7946 0.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0878 0.3533 1.1476 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3124 1.6443 0.5567 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8844 1.5718 0.3458 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2459 2.9460 0.2483 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4484 3.7695 1.4853 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7169 3.7016 -0.9591 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1598 0.7970 1.3563 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7668 0.4209 2.4182 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1948 0.4236 1.2457 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8311 -0.1073 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0984 0.6091 -0.2319 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4999 1.4310 0.6463 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 0.4700 -1.3761 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1359 1.1986 -1.5798 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9456 2.6513 -1.5855 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8164 3.1574 -1.4263 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0236 3.4899 -1.7691 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2618 -3.6534 0.6891 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4576 -4.0234 0.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6599 -4.3064 -0.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8924 -2.3351 -1.5909 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1304 -1.6705 -0.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -1.4575 2.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3696 -0.7884 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1442 -2.5518 1.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7109 -1.1655 -1.5001 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1611 -2.6581 0.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6983 -3.7883 2.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5288 -4.2922 3.0536 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6684 -1.7403 -1.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7679 -2.4489 -2.7669 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1712 0.7016 -1.9271 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1337 1.7863 -1.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8315 -0.6784 0.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 0.1694 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2479 0.9993 0.4237 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5802 2.5364 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6909 1.1005 -0.6403 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8453 2.7769 0.1276 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1515 4.6035 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8674 3.2311 2.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5098 4.2876 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7776 3.9765 -0.7825 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1459 4.6525 -0.9984 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 3.1467 -1.8997 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8066 0.5342 2.0972 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2345 -0.0537 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -0.1735 -2.1268 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8534 0.9105 -0.7561 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6594 0.8347 -2.5059 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6514 3.6265 -0.9864 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 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 8 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 21 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 1 0 32 33 1 0 33 34 2 0 33 35 1 0 28 3 1 0 11 6 1 0 1 36 1 0 1 37 1 0 1 38 1 0 2 39 1 0 2 40 1 0 4 41 1 0 4 42 1 0 4 43 1 0 7 44 1 0 9 45 1 0 10 46 1 0 12 47 1 0 13 48 1 0 14 49 1 0 15 50 1 0 16 51 1 0 17 52 1 0 17 53 1 0 17 54 1 0 20 55 1 0 21 56 1 0 22 57 1 0 23 58 1 0 23 59 1 0 23 60 1 0 24 61 1 0 24 62 1 0 24 63 1 0 27 64 1 0 28 65 1 0 31 66 1 0 32 67 1 0 32 68 1 0 35 69 1 0 M END