LMPK11000023 LIPID_MAPS_STRUCTURE_DATABASE 40 44 0 0 0 999 V2000 10.7235 11.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7235 10.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6032 9.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4828 10.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4828 11.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6032 11.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6032 12.6327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5414 11.2588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8440 11.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8440 10.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8139 8.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8751 8.8462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6432 9.6447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4249 8.0308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8402 10.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9606 9.6703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 10.1781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2014 9.6703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2014 8.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 8.1466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9606 8.6545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3624 9.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0152 8.4421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9327 8.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2188 10.5036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6107 7.9123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1541 9.8790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5210 7.5154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5026 7.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3786 7.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6417 8.7399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1360 9.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0065 6.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6469 8.8723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9125 6.4281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4658 7.5406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1705 7.1503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0944 7.0560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5779 6.1806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0946 7.0749 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 2 0 0 0 6 7 1 0 0 0 5 8 1 1 0 0 1 9 1 0 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 M END > LMPK11000023 > 8-desoxy-19,20-epoxycytochalasin C > > C30H37NO6 > 507.26 > Polyketides [PK] > Cytochalasins [PK11] > > - > > ABSZCAQHXWKEEY-NILIJMHGSA-N > InChI=1S/C30H37NO6/c1-15-10-9-13-21-25(34)17(3)16(2)23-22(14-20-11-7-6-8-12-20)31-29(35)30(21,23)28(36-19(5)32)27-26(37-27)18(4)24(15)33/h6-9,11-13,15,18,21-23,25-28,34H,10,14H2,1-5H3,(H,31,35)/b13-9+/t15-,18+,21-,22-,23-,25+,26+,27-,28+,30-/m0/s1 > C1(C)=C(C)[C@@H](O)[C@]2([H])C=CC[C@H](C)C(=O)[C@@]([H])(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] > - > - > - > - > - > - > 171119149 > - > - > - > - > - > 42375 > 33325741 $$$$