KEGG:C08956 Helianthoside A ISISHOST03240423212D 1 1.00000 0.00000 7996 77 85 0 0 0 999 V2000 11.4042 -18.9208 0.0000 C 0 0 1 0 0 0 0 0 0 12.1287 -19.3366 0.0000 C 0 0 1 0 0 0 0 0 0 10.6875 -19.3357 0.0000 O 0 0 0 0 0 0 0 0 0 12.1269 -20.1642 0.0000 C 0 0 1 0 0 0 0 0 0 12.8474 -18.9166 0.0000 O 0 0 0 0 0 0 0 0 0 10.6884 -20.1615 0.0000 C 0 0 2 0 0 0 0 0 0 11.4100 -20.5790 0.0000 C 0 0 2 0 0 0 0 0 0 12.8434 -20.5731 0.0000 O 0 0 0 0 0 0 0 0 0 9.9686 -20.5862 0.0000 C 0 0 0 0 0 0 0 0 0 11.4074 -21.4067 0.0000 O 0 0 0 0 0 0 0 0 0 14.9181 -14.2795 0.0000 C 0 0 2 0 0 0 0 0 0 14.1916 -13.8892 0.0000 O 0 0 0 0 0 0 0 0 0 14.9414 -15.1150 0.0000 C 0 0 1 0 0 0 0 0 0 13.4911 -14.3223 0.0000 C 0 0 1 0 0 0 0 0 0 14.2318 -15.5433 0.0000 C 0 0 2 0 0 0 0 0 0 15.6679 -15.5055 0.0000 O 0 0 0 0 0 0 0 0 0 13.5042 -15.1475 0.0000 C 0 0 2 0 0 0 0 0 0 12.7599 -13.9333 0.0000 C 0 0 0 0 0 0 0 0 0 14.2556 -16.3704 0.0000 O 0 0 0 0 0 0 0 0 0 12.8023 -15.5760 0.0000 O 0 0 0 0 0 0 0 0 0 12.7307 -13.1070 0.0000 O 0 0 0 0 0 0 0 0 0 12.0890 -16.0108 0.0000 C 0 0 1 0 0 0 0 0 0 12.0045 -12.7159 0.0000 C 0 0 1 0 0 0 0 0 0 12.1052 -16.8378 0.0000 C 0 0 1 0 0 0 0 0 0 11.3565 -15.6084 0.0000 O 0 0 0 0 0 0 0 0 0 11.3062 -13.1464 0.0000 C 0 0 1 0 0 0 0 0 0 11.9919 -11.8910 0.0000 O 0 0 0 0 0 0 0 0 0 11.3949 -17.2742 0.0000 C 0 0 2 0 0 0 0 0 0 12.8264 -17.2379 0.0000 O 0 0 0 0 0 0 0 0 0 10.6516 -16.0353 0.0000 C 0 0 2 0 0 0 0 0 0 10.5750 -12.7574 0.0000 C 0 0 2 0 0 0 0 0 0 11.3271 -13.9720 0.0000 O 0 0 0 0 0 0 0 0 0 11.2608 -11.4934 0.0000 C 0 0 0 0 0 0 0 0 0 11.4098 -18.0965 0.0000 O 0 0 0 0 0 0 0 0 0 10.6630 -16.8636 0.0000 C 0 0 2 0 0 0 0 0 0 9.9273 -15.6335 0.0000 C 0 0 0 0 0 0 0 0 0 10.5511 -11.9215 0.0000 C 0 0 1 0 0 0 0 0 0 9.8701 -13.1842 0.0000 O 0 0 0 0 0 0 0 0 0 9.9544 -17.2970 0.0000 O 0 0 0 0 0 0 0 0 0 9.8230 -11.5342 0.0000 O 0 0 0 0 0 0 0 0 0 19.9533 -11.4049 0.0000 C 0 0 0 0 0 0 0 0 0 19.9422 -12.2295 0.0000 C 0 0 2 0 0 0 0 0 0 20.6668 -11.0036 0.0000 C 0 0 1 0 0 0 0 0 0 19.2398 -10.9856 0.0000 C 0 0 0 0 0 0 0 0 0 19.2288 -12.6350 0.0000 C 0 0 1 0 0 0 0 0 0 20.6523 -12.6454 0.0000 C 0 0 0 0 0 0 0 0 0 19.9353 -13.0543 0.0000 C 0 0 0 0 0 0 0 0 0 21.3768 -11.4304 0.0000 C 0 0 1 0 0 0 0 0 0 20.6772 -10.1754 0.0000 C 0 0 0 0 0 0 0 0 0 18.5263 -11.3980 0.0000 C 0 0 0 0 0 0 0 0 0 18.5186 -12.2226 0.0000 C 0 0 2 0 0 0 0 0 0 19.2288 -13.4632 0.0000 C 0 0 0 0 0 0 0 0 0 19.2142 -11.7992 0.0000 C 0 0 0 0 0 0 0 0 0 21.3658 -12.2475 0.0000 C 0 0 2 0 0 0 0 0 0 22.0939 -11.0216 0.0000 C 0 0 0 0 0 0 0 0 0 22.0904 -11.8351 0.0000 C 0 0 0 0 0 0 0 0 0 21.3983 -9.7810 0.0000 C 0 0 3 0 0 0 0 0 0 17.7906 -12.6316 0.0000 C 0 0 2 0 0 0 0 0 0 18.5083 -13.8790 0.0000 C 0 0 0 0 0 0 0 0 0 21.3624 -13.0799 0.0000 O 0 0 0 0 0 0 0 0 0 22.1083 -10.1933 0.0000 C 0 0 0 0 0 0 0 0 0 22.8039 -11.4159 0.0000 O 0 0 0 0 0 0 0 0 0 22.0904 -12.6599 0.0000 O 0 0 0 0 0 0 0 0 0 21.8107 -9.0599 0.0000 C 0 0 0 0 0 0 0 0 0 20.9859 -9.0599 0.0000 C 0 0 0 0 0 0 0 0 0 17.7906 -13.4563 0.0000 C 0 0 1 0 0 0 0 0 0 17.0772 -12.2226 0.0000 C 0 0 0 0 0 0 0 0 0 17.7906 -11.7992 0.0000 C 0 0 0 0 0 0 0 0 0 17.0772 -13.8755 0.0000 C 0 0 3 0 0 0 0 0 0 16.3602 -12.6316 0.0000 C 0 0 0 0 0 0 0 0 0 16.3602 -13.4563 0.0000 C 0 0 2 0 0 0 0 0 0 16.8589 -14.6754 0.0000 C 0 0 0 0 0 0 0 0 0 17.2927 -14.6754 0.0000 C 0 0 0 0 0 0 0 0 0 15.6398 -13.8755 0.0000 O 0 0 0 0 0 0 0 0 0 20.6557 -11.8207 0.0000 H 0 0 0 0 0 0 0 0 0 18.5118 -13.0440 0.0000 H 0 0 0 0 0 0 0 0 0 17.7872 -14.2734 0.0000 H 0 0 0 0 0 0 0 0 0 31 38 1 1 0 0 35 39 1 1 0 0 37 40 1 6 0 0 15 17 1 0 0 0 30 35 1 0 0 0 33 37 1 0 0 0 6 9 1 6 0 0 7 10 1 1 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 11 12 1 0 0 0 11 13 1 0 0 0 12 14 1 0 0 0 13 15 1 0 0 0 13 16 1 6 0 0 14 17 1 0 0 0 14 18 1 1 0 0 15 19 1 1 0 0 17 20 1 6 0 0 18 21 1 0 0 0 22 20 1 1 0 0 23 21 1 1 0 0 22 24 1 0 0 0 22 25 1 0 0 0 23 26 1 0 0 0 23 27 1 0 0 0 24 28 1 0 0 0 24 29 1 6 0 0 25 30 1 0 0 0 26 31 1 0 0 0 26 32 1 6 0 0 27 33 1 0 0 0 28 34 1 6 0 0 28 35 1 0 0 0 30 36 1 6 0 0 31 37 1 0 0 0 41 42 1 0 0 0 41 43 1 0 0 0 41 44 2 0 0 0 42 45 1 0 0 0 42 46 1 0 0 0 42 47 1 6 0 0 43 48 1 0 0 0 43 49 1 0 0 0 44 50 1 0 0 0 45 51 1 0 0 0 45 52 1 0 0 0 45 53 1 1 0 0 46 54 1 0 0 0 48 55 1 0 0 0 48 56 1 1 0 0 49 57 1 0 0 0 51 58 1 0 0 0 52 59 1 0 0 0 54 60 1 6 0 0 55 61 1 0 0 0 56 62 1 0 0 0 56 63 2 0 0 0 57 64 1 0 0 0 57 65 1 0 0 0 58 66 1 0 0 0 58 67 1 0 0 0 58 68 1 1 0 0 66 69 1 0 0 0 67 70 1 0 0 0 69 71 1 0 0 0 69 72 1 0 0 0 69 73 1 0 0 0 71 74 1 1 0 0 48 54 1 0 0 0 50 51 1 0 0 0 57 61 1 0 0 0 59 66 1 0 0 0 70 71 1 0 0 0 43 75 1 1 0 0 51 76 1 6 0 0 66 77 1 6 0 0 11 74 1 1 0 0 1 34 1 1 0 0 M END