-ISIS- 05031710462D 79 87 0 0 0 0 0 0 0 0999 V2000 1.4167 -6.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4167 -7.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1333 -7.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -6.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1333 -6.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 -7.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -7.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -6.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5583 -6.0750 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 -6.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2750 -4.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -4.8375 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4208 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4208 -6.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -4.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1375 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1375 -4.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1250 -3.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -5.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -4.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1375 -3.1792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8542 -3.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5708 -4.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -3.6000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0042 -4.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -2.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7208 -3.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 -6.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9917 -6.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7083 -5.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4208 -4.4250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4292 -4.0125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4292 -4.8375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1458 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8625 -4.8375 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8625 -4.0125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.1458 -3.5917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5792 -3.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1458 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7208 -5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5792 -5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2958 -4.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0167 -7.3125 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0167 -6.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -6.0750 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4500 -6.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4500 -7.3125 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7333 -7.7292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7333 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -7.7292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -6.0750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -8.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1625 -8.5542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8792 -8.9667 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8792 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1625 -10.2042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4500 -9.7917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5958 -8.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -11.0292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5958 -10.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7333 -10.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0167 -4.8375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1625 -5.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4458 -4.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4458 -4.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1625 -3.5958 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.8792 -4.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8792 -4.8333 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1625 -2.7708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5917 -3.5958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5917 -5.2458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7292 -3.5958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8542 -2.7667 0.0000 C 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 2 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 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 11 17 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 6 0 0 0 5 22 1 1 0 0 0 9 23 1 1 0 0 0 12 24 1 1 0 0 0 20 25 1 6 0 0 0 20 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 1 0 0 0 29 31 1 0 0 0 0 10 32 1 6 0 0 0 11 33 1 6 0 0 0 15 34 1 6 0 0 0 16 35 1 6 0 0 0 36 31 1 6 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 40 42 1 6 0 0 0 38 43 1 6 0 0 0 37 44 1 1 0 0 0 39 45 1 1 0 0 0 42 46 1 0 0 0 0 2 47 1 1 0 0 0 48 47 1 1 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 53 1 0 0 0 0 53 48 1 0 0 0 0 50 54 1 1 0 0 0 52 55 1 1 0 0 0 51 56 1 1 0 0 0 53 57 1 6 0 0 0 58 57 1 1 0 0 0 58 59 1 0 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 58 1 0 0 0 0 60 64 1 6 0 0 0 62 65 1 6 0 0 0 61 66 1 1 0 0 0 63 67 1 6 0 0 0 54 68 1 0 0 0 0 69 56 1 1 0 0 0 69 70 1 0 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 69 1 0 0 0 0 72 75 1 1 0 0 0 73 76 1 6 0 0 0 74 77 1 6 0 0 0 71 78 1 6 0 0 0 25 79 1 0 0 0 0 M END > CFN99585 > Methyl protodioscin > 54522-52-0 > 98% > C52H86O22 > 1063.23 > White powder > Steroids > Pyridine, Methanol, Ethanol, etc. > http://www.chemfaces.com/natural/Methyl-protodioscin-CFN99585.html $$$$