Mol:FL5FACGS0088
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 64 70 0 0 0 0 0 0 0 0999 V2000 2.3937 3.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3937 2.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1081 1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8226 2.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8226 3.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1081 3.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6792 1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9647 2.3977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2503 1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2503 1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9647 0.7478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6792 1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4641 2.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1786 1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1786 1.1602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4641 0.7478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9647 -0.0772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8931 2.3977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3937 0.7478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4641 -0.0772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4144 3.5644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4511 2.0348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 1.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8696 0.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0761 1.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2778 0.9869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8651 1.7016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6587 1.4749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2825 0.2478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6747 0.5104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4511 1.1132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2121 1.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2735 -1.0767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0543 -1.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5184 -0.6617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2655 -0.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4848 -0.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0205 -0.7260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3975 -0.5362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3318 -0.7046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 -1.6773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5267 -1.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3694 -0.7644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4358 -3.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2567 -3.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5549 -2.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2035 -1.8242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3825 -1.7399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0843 -2.5093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5396 -2.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0767 -2.9765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -3.6352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8266 -3.5441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3044 -2.3132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0027 -0.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7173 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9168 -1.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3301 -1.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6153 -1.3962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4159 -1.1957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6101 -2.3636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6186 -1.5618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1139 -0.6315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6148 -0.4515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 1 0 0 0 26 25 1 1 0 0 0 27 26 1 1 0 0 0 27 28 1 0 0 0 0 28 23 1 0 0 0 0 26 29 1 0 0 0 0 25 30 1 0 0 0 0 24 31 1 0 0 0 0 23 32 1 0 0 0 0 27 18 1 0 0 0 0 33 34 1 1 0 0 0 34 35 1 1 0 0 0 36 35 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 33 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 33 41 1 0 0 0 0 34 42 1 0 0 0 0 35 43 1 0 0 0 0 36 19 1 0 0 0 0 44 45 1 1 0 0 0 45 46 1 1 0 0 0 47 46 1 1 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 44 1 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 44 52 1 0 0 0 0 45 53 1 0 0 0 0 46 54 1 0 0 0 0 47 43 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 1 0 0 0 58 57 1 1 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 55 1 0 0 0 0 58 61 1 0 0 0 0 57 62 1 0 0 0 0 56 63 1 0 0 0 0 55 64 1 0 0 0 0 59 40 1 0 0 0 0 S SKP 5 ID FL5FACGS0088 FORMULA C39H50O25 EXACTMASS 918.26411715 AVERAGEMASS 918.7993 SMILES C(C(OC(O6)C(C(C(O)C6COC(C7O)OC(C(C7O)O)C)O)OC(C(O)5)OC(C(O)C5O)CO)=3)(c(c1OC3c(c4)cc(O)c(O)c4)c(cc(OC(O2)C(C(O)C(C2C)O)O)c1)O)=O M END
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