Mol:FL5FECGS0048
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 50 54 0 0 0 0 0 0 0 0999 V2000 | + | 50 54 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.0650 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0650 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0650 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0650 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3505 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3505 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3640 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3640 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3640 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3640 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3505 0.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3505 0.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0785 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0785 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7930 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7930 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7930 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7930 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0785 0.4378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0785 0.4378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0785 -1.8555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0785 -1.8555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6927 0.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6927 0.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4209 0.1761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4209 0.1761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1491 0.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1491 0.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1491 1.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1491 1.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4209 1.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4209 1.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6927 1.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6927 1.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3505 -2.0370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3505 -2.0370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8061 1.8036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8061 1.8036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7052 0.4274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7052 0.4274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6261 -1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6261 -1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4382 -2.6611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4382 -2.6611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1258 -3.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1258 -3.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9076 -2.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9076 -2.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1258 -1.5265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1258 -1.5265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4382 -1.1293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4382 -1.1293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6563 -1.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6563 -1.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4995 -1.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4995 -1.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5130 -3.3629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5130 -3.3629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0042 -3.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0042 -3.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4631 -2.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4631 -2.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1583 0.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1583 0.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4837 0.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4837 0.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6977 0.9413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6977 0.9413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4837 1.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4837 1.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1583 2.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1583 2.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9443 1.3353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9443 1.3353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7897 2.6384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7897 2.6384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5288 2.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5288 2.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6542 1.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6542 1.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.7680 0.5720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.7680 0.5720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4209 2.6986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4209 2.6986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3748 1.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3748 1.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8061 2.5131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8061 2.5131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7187 1.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7187 1.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7897 3.3525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7897 3.3525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3566 3.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3566 3.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1611 3.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1611 3.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6461 -1.1352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6461 -1.1352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7284 -1.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7284 -1.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 2 0 0 0 0 | + | 2 3 2 0 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 6 1 2 0 0 0 0 | + | 6 1 2 0 0 0 0 |
| − | 4 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 2 0 0 0 0 | + | 8 9 2 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 5 1 0 0 0 0 | + | 10 5 1 0 0 0 0 |
| − | 7 11 2 0 0 0 0 | + | 7 11 2 0 0 0 0 |
| − | 9 12 1 0 0 0 0 | + | 9 12 1 0 0 0 0 |
| − | 12 13 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 2 0 0 0 0 | + | 14 15 2 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 17 12 1 0 0 0 0 | + | 17 12 1 0 0 0 0 |
| − | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
| − | 19 15 1 0 0 0 0 | + | 19 15 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 1 20 1 0 0 0 0 | + | 1 20 1 0 0 0 0 |
| − | 21 8 1 0 0 0 0 | + | 21 8 1 0 0 0 0 |
| − | 23 22 1 1 0 0 0 | + | 23 22 1 1 0 0 0 |
| − | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
| − | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
| − | 27 22 1 1 0 0 0 | + | 27 22 1 1 0 0 0 |
| − | 27 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
| − | 22 29 1 0 0 0 0 | + | 22 29 1 0 0 0 0 |
| − | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
| − | 24 31 1 0 0 0 0 | + | 24 31 1 0 0 0 0 |
| − | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
| − | 33 32 1 1 0 0 0 | + | 33 32 1 1 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 34 35 1 0 0 0 0 | + | 34 35 1 0 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 36 37 1 1 0 0 0 | + | 36 37 1 1 0 0 0 |
| − | 37 32 1 1 0 0 0 | + | 37 32 1 1 0 0 0 |
| − | 36 38 1 0 0 0 0 | + | 36 38 1 0 0 0 0 |
| − | 35 39 1 0 0 0 0 | + | 35 39 1 0 0 0 0 |
| − | 37 40 1 0 0 0 0 | + | 37 40 1 0 0 0 0 |
| − | 32 41 1 0 0 0 0 | + | 32 41 1 0 0 0 0 |
| − | 20 33 1 0 0 0 0 | + | 20 33 1 0 0 0 0 |
| − | 16 42 1 0 0 0 0 | + | 16 42 1 0 0 0 0 |
| − | 43 44 2 0 0 0 0 | + | 43 44 2 0 0 0 0 |
| − | 43 45 1 0 0 0 0 | + | 43 45 1 0 0 0 0 |
| − | 40 43 1 0 0 0 0 | + | 40 43 1 0 0 0 0 |
| − | 38 46 1 0 0 0 0 | + | 38 46 1 0 0 0 0 |
| − | 46 47 2 0 0 0 0 | + | 46 47 2 0 0 0 0 |
| − | 46 48 1 0 0 0 0 | + | 46 48 1 0 0 0 0 |
| − | 49 50 1 0 0 0 0 | + | 49 50 1 0 0 0 0 |
| − | 2 49 1 0 0 0 0 | + | 2 49 1 0 0 0 0 |
| − | M STY 1 1 SUP | + | M STY 1 1 SUP |
| − | M SLB 1 1 1 | + | M SLB 1 1 1 |
| − | M SAL 1 2 49 50 | + | M SAL 1 2 49 50 |
| − | M SBL 1 1 54 | + | M SBL 1 1 54 |
| − | M SMT 1 ^OCH3 | + | M SMT 1 ^OCH3 |
| − | M SBV 1 54 0.5811 0.3355 | + | M SBV 1 54 0.5811 0.3355 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FECGS0048 | + | ID FL5FECGS0048 |
| − | FORMULA C32H36O18 | + | FORMULA C32H36O18 |
| − | EXACTMASS 708.190164348 | + | EXACTMASS 708.190164348 |
| − | AVERAGEMASS 708.61744 | + | AVERAGEMASS 708.61744 |
| − | SMILES CC(=O)OC(C5OC(C)=O)C(O)C(OC5C)Oc(c(OC)4)cc(c(c4O)2)OC(=C(OC(C(O)3)OC(C(O)C3O)C)C2=O)c(c1)ccc(O)c1O | + | SMILES CC(=O)OC(C5OC(C)=O)C(O)C(OC5C)Oc(c(OC)4)cc(c(c4O)2)OC(=C(OC(C(O)3)OC(C(O)C3O)C)C2=O)c(c1)ccc(O)c1O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
50 54 0 0 0 0 0 0 0 0999 V2000
-1.0650 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0650 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3505 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3640 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3640 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3505 0.4378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0785 -1.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7930 -0.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7930 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0785 0.4378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0785 -1.8555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6927 0.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4209 0.1761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1491 0.5967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1491 1.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4209 1.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6927 1.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3505 -2.0370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8061 1.8036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7052 0.4274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6261 -1.2845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4382 -2.6611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1258 -3.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9076 -2.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1258 -1.5265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4382 -1.1293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6563 -1.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4995 -1.8929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5130 -3.3629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0042 -3.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4631 -2.6677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1583 0.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4837 0.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6977 0.9413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4837 1.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1583 2.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9443 1.3353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7897 2.6384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5288 2.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6542 1.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7680 0.5720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4209 2.6986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3748 1.7661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8061 2.5131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7187 1.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7897 3.3525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3566 3.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1611 3.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6461 -1.1352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7284 -1.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
3 18 1 0 0 0 0
19 15 1 0 0 0 0
4 3 1 0 0 0 0
1 20 1 0 0 0 0
21 8 1 0 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 1 0 0 0
27 22 1 1 0 0 0
27 28 1 0 0 0 0
22 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
26 21 1 0 0 0 0
33 32 1 1 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 1 0 0 0
37 32 1 1 0 0 0
36 38 1 0 0 0 0
35 39 1 0 0 0 0
37 40 1 0 0 0 0
32 41 1 0 0 0 0
20 33 1 0 0 0 0
16 42 1 0 0 0 0
43 44 2 0 0 0 0
43 45 1 0 0 0 0
40 43 1 0 0 0 0
38 46 1 0 0 0 0
46 47 2 0 0 0 0
46 48 1 0 0 0 0
49 50 1 0 0 0 0
2 49 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 49 50
M SBL 1 1 54
M SMT 1 ^OCH3
M SBV 1 54 0.5811 0.3355
S SKP 5
ID FL5FECGS0048
FORMULA C32H36O18
EXACTMASS 708.190164348
AVERAGEMASS 708.61744
SMILES CC(=O)OC(C5OC(C)=O)C(O)C(OC5C)Oc(c(OC)4)cc(c(c4O)2)OC(=C(OC(C(O)3)OC(C(O)C3O)C)C2=O)c(c1)ccc(O)c1O
M END
