-ISIS- 05031710462D 78 87 0 0 0 0 0 0 0 0999 V2000 6.0125 -7.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7292 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4458 -8.6958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4458 -7.8708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7292 -7.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1583 -9.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -8.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -7.8708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.1583 -7.4625 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5833 -7.4625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5833 -6.6333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8708 -6.2208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1583 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3708 -7.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8542 -7.0458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3708 -6.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6417 -6.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6417 -5.9667 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8542 -5.7125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3917 -6.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0583 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9750 -5.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2208 -4.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5500 -5.1500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6375 -4.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -4.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1583 -8.2833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3042 -9.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4458 -7.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 -5.8125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8708 -7.0458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2667 -7.7625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1542 -7.1792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 -8.2833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 -8.6917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5875 -7.8708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -7.4583 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1625 -7.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1625 -8.6917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8750 -9.1083 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8750 -9.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4458 -7.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4458 -9.1083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 -6.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4458 -6.6333 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1625 -6.2208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1625 -5.3958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.4458 -4.9833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7333 -5.3958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7333 -6.2208 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8750 -4.9833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0208 -4.9833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0208 -6.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4458 -4.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4458 -9.5208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -4.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3083 -7.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4083 -6.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -7.0458 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1208 -7.8708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4083 -8.2833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3083 -7.8708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4083 -9.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8333 -6.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8333 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0208 -8.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5458 -7.0458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3083 -4.5708 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.3083 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4083 -3.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1208 -3.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.1208 -4.5708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4083 -4.9833 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.8333 -4.9833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8333 -3.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4083 -5.8083 0.0000 O 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 6 1 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 10 1 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 12 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 17 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 19 25 1 6 0 0 0 23 26 1 6 0 0 0 20 27 1 6 0 0 0 10 28 1 6 0 0 0 2 29 1 1 0 0 0 5 30 1 1 0 0 0 12 31 1 1 0 0 0 9 32 1 1 0 0 0 16 33 1 6 0 0 0 17 34 1 6 0 0 0 11 35 1 6 0 0 0 36 29 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 36 1 0 0 0 0 41 42 1 6 0 0 0 39 43 1 1 0 0 0 38 44 1 1 0 0 0 40 45 1 1 0 0 0 44 46 1 0 0 0 0 47 43 1 1 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 47 1 0 0 0 0 49 53 1 1 0 0 0 51 54 1 1 0 0 0 52 55 1 6 0 0 0 50 56 1 6 0 0 0 4 57 1 6 0 0 0 53 58 1 0 0 0 0 59 55 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 64 59 1 0 0 0 0 63 65 1 1 0 0 0 61 66 1 1 0 0 0 62 67 1 6 0 0 0 64 68 1 6 0 0 0 66 69 1 0 0 0 0 70 54 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 75 70 1 0 0 0 0 74 76 1 1 0 0 0 73 77 1 6 0 0 0 75 78 1 6 0 0 0 M END > CFN90930 > Tomatine > 17406-45-0 > 98% > C50H83NO21 > 1034.2 > Powder > Alkaloids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Tomatine-CFN90930.html $$$$