CDK 1018121544 83 91 0 0 0 0 0 0 0 0999 V2000 -0.3239 -5.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5048 -5.7510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7657 -6.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1044 -2.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5272 -1.9941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -6.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7873 -4.9223 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -7.0257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2799 -2.0573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3505 -1.2495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1864 -2.7430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -5.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0358 -1.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6097 -1.2621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3665 -4.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8945 -0.8456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7922 -3.2984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1233 -1.2705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -6.5378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5251 -2.7893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -7.0216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2987 -1.2664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0559 -4.5268 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7494 -5.7510 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3498 -2.7809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1093 -0.5427 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3248 -0.8540 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1792 -1.2579 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4724 -6.9585 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1918 -6.5630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3863 -7.5096 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0568 -6.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7753 -4.1229 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7216 -0.7994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5159 -2.8945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7704 -3.4877 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3737 -1.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3433 -2.0867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3291 -7.0174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8945 -6.9879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3401 -5.7847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3378 0.1809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 -4.2197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -5.7763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8945 -0.0210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3113 0.1641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1213 -3.5044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5398 -0.5596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4864 -4.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0947 -5.7805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6223 -6.5925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8776 -7.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7242 -7.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5824 -4.7035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0897 -2.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3291 -0.0295 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4557 -7.7830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0967 0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2142 -4.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5150 -6.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2957 -6.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4275 -2.0446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6387 -8.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 -3.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0325 -5.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7501 -2.5242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4633 -8.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0401 0.3829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1582 -8.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7363 -8.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 0.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2268 -3.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9297 0.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3282 1.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9209 -4.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0442 1.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3378 1.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0757 2.3223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6488 -4.1734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9462 -2.9071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9171 2.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6615 -3.3362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 2 0 0 0 0 4 21 1 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 7 25 1 0 0 0 0 8 32 1 0 0 0 0 9 13 2 0 0 0 0 10 14 1 0 0 0 0 11 18 2 0 0 0 0 12 1 1 0 0 0 0 13 28 1 0 0 0 0 14 27 1 0 0 0 0 15 17 1 0 0 0 0 16 7 1 0 0 0 0 29 17 1 6 0 0 0 18 34 1 0 0 0 0 19 5 1 0 0 0 0 20 1 2 0 0 0 0 21 26 1 0 0 0 0 22 20 1 0 0 0 0 23 19 1 0 0 0 0 24 12 1 0 0 0 0 25 6 1 1 0 0 0 26 37 1 0 0 0 0 27 23 1 0 0 0 0 28 15 1 1 0 0 0 29 10 1 0 0 0 0 30 3 1 0 0 0 0 31 30 1 0 0 0 0 32 33 1 1 0 0 0 33 40 1 0 0 0 0 34 24 1 0 0 0 0 35 13 1 0 0 0 0 36 18 1 0 0 0 0 37 16 1 0 0 0 0 38 35 1 0 0 0 0 39 36 1 0 0 0 0 40 52 1 0 0 0 0 41 31 1 0 0 0 0 42 6 2 0 0 0 0 43 14 2 0 0 0 0 44 16 2 0 0 0 0 45 12 2 0 0 0 0 46 17 2 0 0 0 0 27 47 1 1 0 0 0 48 21 2 0 0 0 0 49 19 2 0 0 0 0 34 50 1 1 0 0 0 51 33 2 0 0 0 0 52 41 1 0 0 0 0 53 41 2 0 0 0 0 54 8 1 0 0 0 0 55 7 1 0 0 0 0 56 10 1 0 0 0 0 57 28 1 0 0 0 0 30 58 1 1 0 0 0 59 47 1 0 0 0 0 60 50 1 0 0 0 0 61 25 1 0 0 0 0 62 20 1 0 0 0 0 63 29 1 0 0 0 0 64 32 1 0 0 0 0 37 65 1 1 0 0 0 66 61 1 0 0 0 0 67 56 1 0 0 0 0 68 64 1 0 0 0 0 69 57 1 0 0 0 0 70 58 1 0 0 0 0 71 58 1 0 0 0 0 57 72 1 1 0 0 0 73 60 2 0 0 0 0 74 59 2 0 0 0 0 75 59 1 0 0 0 0 76 60 1 0 0 0 0 77 69 1 0 0 0 0 78 74 1 0 0 0 0 79 75 2 0 0 0 0 80 76 2 0 0 0 0 81 73 1 0 0 0 0 82 79 1 0 0 0 0 83 80 1 0 0 0 0 3 22 1 0 0 0 0 39 5 2 0 0 0 0 83 81 2 0 0 0 0 54 68 1 0 0 0 0 63 67 1 0 0 0 0 55 66 1 0 0 0 0 82 78 2 0 0 0 0 4 9 1 0 0 0 0 38 4 2 0 0 0 0 M END > CHEBI:70163 > Wewakazole > A natural product found in Lyngbya species. > 2 > C59H72N12O12 > 1141.27620 > 1140.53927 > 0 > CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)c2coc(n2)[C@H](Cc2ccccc2)NC(=O)c2nc(oc2C)[C@@H](NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)c2coc1n2)C(C)C > InChI=1S/C59H72N12O12/c1-7-33(4)47-55-65-40(31-82-55)49(73)61-34(5)57(78)71-26-16-23-44(71)59(80)70-25-14-21-42(70)51(75)60-29-45(72)66-46(32(2)3)56-68-48(35(6)83-56)53(77)62-38(27-36-17-10-8-11-18-36)54-64-41(30-81-54)50(74)63-39(28-37-19-12-9-13-20-37)58(79)69-24-15-22-43(69)52(76)67-47/h8-13,17-20,30-34,38-39,42-44,46-47H,7,14-16,21-29H2,1-6H3,(H,60,75)(H,61,73)(H,62,77)(H,63,74)(H,66,72)(H,67,76)/t33-,34-,38-,39-,42-,43-,44-,46-,47-/m0/s1 > LRFQMOZAQWOOPZ-IBFZZIGPSA-N > 21155594 $$$$