Mrv1652304282205572D 26 28 0 0 1 0 999 V2000 -3.5724 0.4125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8579 -0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8579 -0.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5724 -1.2375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.2868 -0.8250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2868 -0.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.0714 0.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3264 1.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5564 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3814 -0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0714 -1.0799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4008 -2.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9529 -2.6576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5803 -2.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1678 -2.8452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2448 -1.3770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.8250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.4125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 1.1409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9597 1.1409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5225 1.8406 0.0000 C 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 1 6 1 0 0 0 0 6 7 1 6 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 5 11 1 6 0 0 0 4 12 1 1 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 3 16 1 1 0 0 0 2 17 1 6 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 1 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 1 24 1 6 0 0 0 1 25 1 1 0 0 0 25 26 2 0 0 0 0 M END > NP0058611 > NP-MRD > CC[C@H](C)C(=O)O[C@@H]1[C@H]2OC(=O)C(=C)[C@H]2[C@@H]2OC(=O)C(=C)[C@@H]2[C@@]1(C)C=C > InChI=1S/C20H24O6/c1-7-9(3)17(21)26-16-15-12(10(4)18(22)25-15)14-13(20(16,6)8-2)11(5)19(23)24-14/h8-9,12-16H,2,4-5,7H2,1,3,6H3/t9-,12-,13-,14-,15-,16+,20+/m0/s1 > RVPNMMMHNAJZDK-NALFQJMYSA-N > C20H24O6 > 360.406 > 360.157288493 > 3 > 50 > 36.82808056614733 > 1 > 0 > 0 > 1 > (1S,2R,6S,7R,8S,9S)-7-ethenyl-7-methyl-5,12-dimethylidene-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0^{2,6}]dodecan-8-yl (2S)-2-methylbutanoate > 2.56 > 3.5502222789999998 > -3.24 > 0 > 3 > 0 > -6.455219919226362 > 78.9 > 91.9238 > 5 > 1 > 2.09e-01 g/l > (1S,2R,6S,7R,8S,9S)-7-ethenyl-7-methyl-5,12-dimethylidene-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0^{2,6}]dodecan-8-yl (2S)-2-methylbutanoate > 0 > NP0058611 > Zinaflavin A $$$$