LMPK11000033 LIPID_MAPS_STRUCTURE_DATABASE 40 44 0 0 0 999 V2000 11.9004 11.8283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9004 10.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7914 10.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6824 10.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6824 11.8283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7914 12.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0095 12.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0095 11.3139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5734 10.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1484 9.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1625 9.4370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8839 10.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2556 8.6226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 10.7996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3552 10.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9929 10.8853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 10.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0732 10.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7552 9.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5876 8.7877 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4199 9.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3848 11.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3785 10.9215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 9.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7489 9.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3552 9.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 8.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 7.7132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9725 6.9858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0295 6.9858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0487 9.3421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6059 8.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4344 7.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5771 9.0635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7914 13.3714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2462 8.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4480 7.4120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7000 6.2583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5796 6.0606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5484 12.3283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 1 7 1 0 0 0 0 2 8 1 1 0 0 0 4 9 1 6 0 0 0 3 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 2 12 1 0 0 0 0 10 13 2 0 0 0 0 9 14 2 0 0 0 0 14 15 1 0 0 0 0 12 16 1 1 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 17 2 0 0 0 0 18 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 19 1 0 0 0 0 15 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 3 31 1 1 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 33 30 1 0 0 0 0 31 34 2 0 0 0 0 6 35 1 0 0 0 0 26 36 1 6 0 0 0 28 37 1 0 0 0 0 29 38 1 1 0 0 0 30 39 2 0 0 0 0 5 40 1 0 0 0 M END > LMPK11000033 > Chaetoglobosin B > > C32H36N2O5 > 528.26 > Polyketides [PK] > Cytochalasins [PK11] > > - > > VUEFRYQBOMQOMV-BEQOWTTGSA-N > InChI=1S/C32H36N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-14,16-17,23,25,28-30,33,37-38H,8,15H2,1-4H3,(H,34,39)/b10-7+,13-12+,18-14+/t17-,23-,25-,28-,29+,30?,32+/m0/s1 > C1(C)=C(C)C(O)[C@@H]2C=CC[C@H](C)C=C(C)[C@@H](O)C(=O)C=CC(=O)[C@@]32C(=O)N[C@@H](CC2=CNC4C=CC=CC2=4)[C@]13[H] > - > - > - > - > - > - > - > - > - > - > - > - > 38033 > 7199054 $$$$