LMPK11000024 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 999 V2000 10.7233 11.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7233 10.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6030 9.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4826 10.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4826 11.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6030 11.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6030 12.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5412 11.2586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8439 11.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8439 10.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8137 8.8338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8750 8.8461 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6431 9.6446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4247 8.0307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8401 10.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9605 9.6702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0809 10.1779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2013 9.6702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2013 8.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0809 8.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9605 8.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3622 9.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0150 8.4420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9325 8.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2186 10.5034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6105 7.9122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1539 9.8789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5208 7.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5024 7.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3784 7.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6415 8.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1358 9.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0063 6.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6466 8.8722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9123 6.4280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4656 7.5405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1702 7.1502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0942 7.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5777 6.1805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0944 7.0748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9150 12.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9051 12.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2986 12.9736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 1 1 0 0 0 6 7 2 0 0 0 5 8 1 1 0 0 1 9 1 6 0 0 2 10 1 1 0 0 3 11 1 6 0 0 11 12 1 0 0 0 12 13 1 0 0 0 2 13 1 0 0 0 11 14 2 0 0 0 13 15 1 1 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 19 20 1 0 0 0 20 21 2 0 0 0 21 16 1 0 0 0 4 22 1 0 0 0 23 24 1 0 0 0 24 3 1 0 0 0 4 25 1 1 0 0 24 26 1 1 0 0 32 27 1 0 0 0 31 32 1 0 0 0 30 31 1 0 0 0 29 30 1 0 0 0 28 29 1 0 0 0 23 28 1 0 0 0 22 27 2 0 0 0 29 33 1 0 0 0 31 34 1 6 0 0 29 35 1 6 0 0 23 36 1 1 0 0 28 36 1 1 0 0 30 37 2 0 0 0 26 38 1 0 0 0 38 39 1 0 0 0 38 40 2 0 0 0 8 41 1 0 0 0 41 42 1 0 0 0 41 43 2 0 0 0 M END > LMPK11000024 > 7-O-acetyl-19,20-epoxycytochalasin D > > C32H39NO8 > 565.27 > Polyketides [PK] > Cytochalasins [PK11] > > - > > YHZFHLRLOBSXDU-BVHWIQSUSA-N > InChI=1S/C32H39NO8/c1-16-11-10-14-22-25(39-19(4)34)18(3)17(2)24-23(15-21-12-8-7-9-13-21)33-30(37)32(22,24)29(40-20(5)35)26-28(41-26)31(6,38)27(16)36/h7-10,12-14,16-17,22-26,28-29,38H,3,11,15H2,1-2,4-6H3,(H,33,37)/b14-10+/t16-,17+,22-,23-,24-,25+,26-,28-,29+,31-,32-/m0/s1 > [C@@H]1(C)C(=C)[C@@H](OC(=O)C)[C@]2([H])C=CC[C@H](C)C(=O)[C@@](O)(C)[C@H]3O[C@@H]3[C@@H](OC(=O)C)[C@@]32C(=O)N[C@@H](CC2C=CC=CC=2)[C@]13[H] > - > - > - > - > - > - > - > - > - > - > - > - > 42375 > 33325741 $$$$