KEGG:C08850 Aspecioside ISISHOST03240423212D 1 1.00000 0.00000 7890 42 48 0 0 0 999 V2000 2.2875 -14.3542 0.0000 C 0 0 1 0 0 0 0 0 0 2.2602 -15.1699 0.0000 C 0 0 1 0 0 0 0 0 0 1.5907 -13.9205 0.0000 O 0 0 0 0 0 0 0 0 0 1.5390 -15.5536 0.0000 C 0 0 1 0 0 0 0 0 0 2.9530 -15.5969 0.0000 O 0 0 0 0 0 0 0 0 0 0.8725 -14.3062 0.0000 C 0 0 1 0 0 0 0 0 0 0.8481 -15.1236 0.0000 C 0 0 1 0 0 0 0 0 0 1.5117 -16.3694 0.0000 O 0 0 0 0 0 0 0 0 0 0.1786 -13.8743 0.0000 C 0 0 0 0 0 0 0 0 0 0.1270 -15.5075 0.0000 O 0 0 0 0 0 0 0 0 0 6.6203 -12.9275 0.0000 C 0 0 1 0 0 0 0 0 0 7.3272 -12.5240 0.0000 C 0 0 2 0 0 0 0 0 0 5.9203 -12.5137 0.0000 C 0 0 1 0 0 0 0 0 0 6.6203 -13.7413 0.0000 C 0 0 1 0 0 0 0 0 0 7.3203 -13.3309 0.0000 O 0 0 0 0 0 0 0 0 0 7.3341 -11.7102 0.0000 C 0 0 1 0 0 0 0 0 0 8.7341 -12.5413 0.0000 C 0 0 0 0 0 0 0 0 0 7.7272 -13.2240 0.0000 O 0 0 0 0 0 0 0 0 0 5.2099 -12.9206 0.0000 C 0 0 2 0 0 0 0 0 0 5.9272 -11.6999 0.0000 C 0 0 0 0 0 0 0 0 0 5.9134 -14.1482 0.0000 C 0 0 0 0 0 0 0 0 0 8.0478 -11.3137 0.0000 C 0 0 2 0 0 0 0 0 0 6.6341 -11.2999 0.0000 C 0 0 1 0 0 0 0 0 0 7.3306 -10.8964 0.0000 C 0 0 0 0 0 0 0 0 0 8.7444 -11.7275 0.0000 C 0 0 0 0 0 0 0 0 0 5.2065 -13.7378 0.0000 C 0 0 1 0 0 0 0 0 0 4.5030 -12.5102 0.0000 C 0 0 0 0 0 0 0 0 0 5.1996 -12.1033 0.0000 C 0 0 0 0 0 0 0 0 0 8.0444 -10.4964 0.0000 C 0 0 0 0 0 0 0 0 0 6.6306 -10.4792 0.0000 O 0 0 0 0 0 0 0 0 0 4.5030 -14.1447 0.0000 C 0 0 0 0 0 0 0 0 0 3.7961 -12.9206 0.0000 C 0 0 0 0 0 0 0 0 0 7.7892 -9.7240 0.0000 C 0 0 0 0 0 0 0 0 0 8.8582 -10.4930 0.0000 C 0 0 0 0 0 0 0 0 0 3.7961 -13.7378 0.0000 C 0 0 2 0 0 0 0 0 0 8.4513 -9.2447 0.0000 O 0 0 0 0 0 0 0 0 0 9.1065 -9.7206 0.0000 C 0 0 0 0 0 0 0 0 0 3.0892 -14.1447 0.0000 O 0 0 0 0 0 0 0 0 0 9.8823 -9.4654 0.0000 O 0 0 0 0 0 0 0 0 0 5.9134 -13.3344 0.0000 H 0 0 0 0 0 0 0 0 0 5.2030 -14.5620 0.0000 H 0 0 0 0 0 0 0 0 0 8.8417 -11.0958 0.0000 H 0 0 0 0 0 0 0 0 0 6 7 1 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 2 4 1 0 0 0 2 5 1 6 0 0 3 6 1 0 0 0 4 7 1 0 0 0 4 8 1 6 0 0 6 9 1 1 0 0 11 12 1 0 0 0 11 13 1 0 0 0 11 14 1 0 0 0 11 15 1 1 0 0 12 16 1 0 0 0 12 17 1 0 0 0 12 18 1 1 0 0 13 19 1 0 0 0 13 20 1 0 0 0 14 21 1 0 0 0 16 22 1 0 0 0 16 23 1 0 0 0 16 24 1 1 0 0 17 25 1 0 0 0 19 26 1 0 0 0 19 27 1 0 0 0 19 28 1 1 0 0 22 29 1 0 0 0 23 30 1 1 0 0 26 31 1 0 0 0 27 32 1 0 0 0 29 33 1 0 0 0 29 34 2 0 0 0 31 35 1 0 0 0 33 36 1 0 0 0 34 37 1 0 0 0 35 38 1 1 0 0 37 39 2 0 0 0 14 15 1 1 0 0 20 23 1 0 0 0 21 26 1 0 0 0 22 25 1 0 0 0 32 35 1 0 0 0 36 37 1 0 0 0 13 40 1 6 0 0 26 41 1 6 0 0 7 10 1 6 0 0 22 42 1 6 0 0 1 38 1 1 0 0 M END