HMDB0035404 RDKit 3D Isogingerenone B 54 55 0 0 0 0 0 0 0 0999 V2000 -7.1875 -2.4238 1.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7109 -1.0921 1.0911 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9047 -0.0675 0.6029 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6472 -0.2698 0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8432 0.7427 -0.3834 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4769 0.4994 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5176 0.6191 0.2383 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1052 0.3884 -0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8062 0.1201 -1.4699 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5738 -0.1001 -1.8807 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7962 -0.3513 -3.0913 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7089 -0.0409 -0.9427 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -0.3154 -1.6976 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1727 -0.2690 -0.7994 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5884 -1.4177 -0.1723 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6771 -1.4289 0.6676 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0596 -2.6091 1.2777 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3363 -3.7905 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3472 -0.2340 0.8628 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4380 -0.2518 1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9572 0.9348 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6346 2.1197 0.4534 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2568 3.3370 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8606 0.9034 -0.5846 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3498 2.0258 -0.3557 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6224 2.2787 0.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3890 1.2218 0.6203 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6457 1.4907 1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0387 -2.7362 0.0207 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8142 -3.1124 1.6526 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1718 -2.4354 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2543 -1.2648 0.0807 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4781 -0.5505 -1.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2707 1.2354 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5587 1.6546 0.6136 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7921 -0.0601 1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2792 0.4338 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5892 0.0622 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5884 -0.6998 -0.0708 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8212 0.9970 -0.5118 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1584 0.4028 -2.4987 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9201 -1.3384 -2.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0546 -2.3714 -0.3272 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3567 -3.7913 1.5631 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2198 -4.0225 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9172 -4.6568 1.4605 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9497 0.6003 1.8712 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3654 3.1857 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9182 4.1634 0.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1901 3.5579 0.0496 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 1.8334 -1.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7586 2.8523 -0.7246 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9723 3.3024 0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2131 0.7388 1.4591 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 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 16 19 2 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 1 0 21 24 2 0 5 25 2 0 25 26 1 0 26 27 2 0 27 28 1 0 27 3 1 0 24 14 1 0 1 29 1 0 1 30 1 0 1 31 1 0 4 32 1 0 6 33 1 0 6 34 1 0 7 35 1 0 7 36 1 0 8 37 1 0 9 38 1 0 12 39 1 0 12 40 1 0 13 41 1 0 13 42 1 0 15 43 1 0 18 44 1 0 18 45 1 0 18 46 1 0 20 47 1 0 23 48 1 0 23 49 1 0 23 50 1 0 24 51 1 0 25 52 1 0 26 53 1 0 28 54 1 0 M END