Verrucarin K -molcms-06172611172D 35 38 0 0 1 0 0 0 0 0999 V2000 -0.3634 -5.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6936 -4.6263 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6805 -4.7875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -4.6014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5226 -4.0903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1555 -3.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0279 -3.8048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4853 -2.3720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4722 -1.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1179 -0.4370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 0.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5923 0.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9217 1.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6053 0.9693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6229 0.7823 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1229 1.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8660 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7321 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1966 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1844 -2.4437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8309 -3.3791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6906 -3.8898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1786 -4.1371 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8118 -4.9111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3299 0.9440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 6 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 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 14 1 6 0 0 0 15 16 1 0 0 0 0 17 16 1 1 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 15 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 6 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 26 25 1 6 0 0 0 26 21 1 0 0 0 0 26 27 1 0 0 0 0 27 17 1 0 0 0 0 24 28 1 0 0 0 0 21 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 2 1 0 0 0 0 33 34 1 1 0 0 0 20 35 1 6 0 0 0 M END > Verrucarin K > 63739-93-5 > C27H34O8 > > 486.55 > > > > C[C@@H]1CCOC(=O)/C=C/C=C\C(=O)O[C@@H]2C[C@@H]3C(=C)[C@]2([C@]4(CCC(=C[C@H]4O3)C)COC(=O)[C@H]1O)C $$$$