KEGG:C11666 11-Hydroxyiridodial glucoside pentaacetate ISISHOST03240423292D 1 1.00000 0.00000 12666 41 43 0 1 0 999 V2000 2.3452 -7.4919 0.0000 C 0 0 0 0 0 0 0 0 0 3.0739 -7.9085 0.0000 O 0 0 0 0 0 0 0 0 0 2.3452 -6.6544 0.0000 O 0 0 0 0 0 0 0 0 0 1.6185 -7.9089 0.0000 C 0 0 0 0 0 0 0 0 0 6.6602 -7.4108 0.0000 O 0 0 0 0 0 0 0 0 0 5.9400 -7.9324 0.0000 C 0 0 2 0 0 0 0 0 0 5.2276 -7.5113 0.0000 O 0 0 0 0 0 0 0 0 0 5.9353 -8.7618 0.0000 C 0 0 1 0 0 0 0 0 0 4.5078 -7.9242 0.0000 C 0 0 1 0 0 0 0 0 0 5.2184 -9.1699 0.0000 C 0 0 2 0 0 0 0 0 0 6.6618 -9.1800 0.0000 O 0 0 0 0 0 0 0 0 0 4.5033 -8.7536 0.0000 C 0 0 2 0 0 0 0 0 0 3.7927 -7.5077 0.0000 C 0 0 0 0 0 0 0 0 0 5.2168 -10.0010 0.0000 O 0 0 0 0 0 0 0 0 0 3.7835 -9.1664 0.0000 O 0 0 0 0 0 0 0 0 0 7.3906 -9.5910 0.0000 C 0 0 0 0 0 0 0 0 0 7.3918 -10.4264 0.0000 O 0 0 0 0 0 0 0 0 0 8.1108 -9.1740 0.0000 C 0 0 0 0 0 0 0 0 0 5.2192 -10.8332 0.0000 C 0 0 0 0 0 0 0 0 0 4.4970 -11.2444 0.0000 O 0 0 0 0 0 0 0 0 0 5.9350 -11.2483 0.0000 C 0 0 0 0 0 0 0 0 0 3.0538 -9.5776 0.0000 C 0 0 0 0 0 0 0 0 0 2.3402 -9.1591 0.0000 O 0 0 0 0 0 0 0 0 0 3.0480 -10.4080 0.0000 C 0 0 0 0 0 0 0 0 0 6.6531 -6.5128 0.0000 C 0 0 1 0 0 0 0 0 0 5.9549 -6.0974 0.0000 C 0 0 1 0 0 0 0 0 0 5.9549 -5.2804 0.0000 C 0 0 1 0 0 0 0 0 0 5.1766 -6.3444 0.0000 C 0 0 2 0 0 0 0 0 0 6.6531 -4.8789 0.0000 C 0 0 0 0 0 0 0 0 0 5.1801 -5.0362 0.0000 C 0 0 0 0 0 0 0 0 0 7.3618 -6.0974 0.0000 O 0 0 0 0 0 0 0 0 0 4.7011 -5.6855 0.0000 C 0 0 0 0 0 0 0 0 0 4.5629 -6.9506 0.0000 C 0 0 0 0 0 0 0 0 0 7.3618 -5.2804 0.0000 C 0 0 0 0 0 0 0 0 0 6.6497 -4.0689 0.0000 C 0 0 0 0 0 0 0 0 0 7.3514 -3.6713 0.0000 O 0 0 0 0 0 0 0 0 0 5.9549 -6.9075 0.0000 H 0 0 0 0 0 0 0 0 0 5.9549 -4.4739 0.0000 H 0 0 0 0 0 0 0 0 0 8.0591 -4.0841 0.0000 C 0 0 0 0 0 0 0 0 0 8.7720 -3.6802 0.0000 C 0 0 0 0 0 0 0 0 0 8.0540 -4.9049 0.0000 O 0 0 0 0 0 0 0 0 0 9 12 1 0 0 0 9 13 1 1 0 0 22 15 1 0 0 0 22 23 2 0 0 0 10 14 1 1 0 0 22 24 1 0 0 0 12 15 1 6 0 0 25 5 1 1 0 0 10 12 1 0 0 0 13 2 1 0 0 0 6 5 1 1 0 0 6 7 1 0 0 0 6 8 1 0 0 0 7 9 1 0 0 0 1 4 1 0 0 0 1 2 1 0 0 0 16 11 1 0 0 0 16 17 2 0 0 0 1 3 2 0 0 0 16 18 1 0 0 0 26 27 1 0 0 0 26 25 1 0 0 0 26 28 1 0 0 0 27 29 1 0 0 0 27 30 1 0 0 0 25 31 1 0 0 0 28 32 1 0 0 0 28 33 1 1 0 0 29 34 2 0 0 0 29 35 1 0 0 0 35 36 1 0 0 0 30 32 1 0 0 0 31 34 1 0 0 0 26 37 1 1 0 0 27 38 1 1 0 0 8 10 1 0 0 0 19 14 1 0 0 0 19 20 2 0 0 0 36 39 1 0 0 0 8 11 1 6 0 0 39 40 1 0 0 0 19 21 1 0 0 0 39 41 2 0 0 0 M END