Mol:FL5FECGS0050
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 53 57 0 0 0 0 0 0 0 0999 V2000 | + | 53 57 0 0 0 0 0 0 0 0999 V2000 |
| − | -1.1636 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1636 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1636 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1636 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4492 -0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4492 -0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2653 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2653 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2653 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2653 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4492 0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4492 0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9797 -0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9797 -0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6942 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6942 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6942 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6942 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9797 0.6572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9797 0.6572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9811 -1.8437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9811 -1.8437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5939 0.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5939 0.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3221 0.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3221 0.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0503 0.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0503 0.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0503 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0503 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3221 2.0771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3221 2.0771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5939 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5939 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4492 -1.8176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4492 -1.8176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8296 2.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8296 2.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8830 0.6869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8830 0.6869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4281 -1.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4281 -1.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1536 -2.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1536 -2.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8412 -2.8180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8412 -2.8180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6230 -2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6230 -2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8412 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8412 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1536 -0.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1536 -0.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3718 -1.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3718 -1.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2149 -1.6528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2149 -1.6528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1665 -3.1433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1665 -3.1433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6372 -3.4826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6372 -3.4826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.1588 -2.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1588 -2.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3185 0.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3185 0.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6440 0.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6440 0.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8581 1.2842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8581 1.2842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6440 2.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6440 2.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3185 2.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3185 2.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1045 1.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1045 1.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8883 2.8576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8883 2.8576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6440 2.5236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6440 2.5236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6892 2.1281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6892 2.1281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9282 0.8945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9282 0.8945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8869 3.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8869 3.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2756 4.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2756 4.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4500 4.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4500 4.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3788 2.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3788 2.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7467 2.7307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7467 2.7307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8655 1.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8655 1.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3221 2.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3221 2.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4297 -3.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4297 -3.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8655 -2.9744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8655 -2.9744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7532 -4.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7532 -4.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8693 -0.9878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8693 -0.9878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9518 -1.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9518 -1.5176 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 |
| − | 38 42 1 0 0 0 0 | + | 38 42 1 0 0 0 0 |
| − | 42 43 1 0 0 0 0 | + | 42 43 1 0 0 0 0 |
| − | 42 44 2 0 0 0 0 | + | 42 44 2 0 0 0 0 |
| − | 40 45 1 0 0 0 0 | + | 40 45 1 0 0 0 0 |
| − | 45 46 2 0 0 0 0 | + | 45 46 2 0 0 0 0 |
| − | 45 47 1 0 0 0 0 | + | 45 47 1 0 0 0 0 |
| − | 16 48 1 0 0 0 0 | + | 16 48 1 0 0 0 0 |
| − | 49 30 1 0 0 0 0 | + | 49 30 1 0 0 0 0 |
| − | 49 50 2 0 0 0 0 | + | 49 50 2 0 0 0 0 |
| − | 49 51 1 0 0 0 0 | + | 49 51 1 0 0 0 0 |
| − | 52 53 1 0 0 0 0 | + | 52 53 1 0 0 0 0 |
| − | 2 52 1 0 0 0 0 | + | 2 52 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 52 53 | + | M SAL 1 2 52 53 |
| − | M SBL 1 1 57 | + | M SBL 1 1 57 |
| − | M SMT 1 ^OCH3 | + | M SMT 1 ^OCH3 |
| − | M SBV 1 57 0.7057 0.4074 | + | M SBV 1 57 0.7057 0.4074 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FECGS0050 | + | ID FL5FECGS0050 |
| − | FORMULA C34H38O19 | + | FORMULA C34H38O19 |
| − | EXACTMASS 750.200729034 | + | EXACTMASS 750.200729034 |
| − | AVERAGEMASS 750.6541199999999 | + | AVERAGEMASS 750.6541199999999 |
| − | SMILES O(C(C5C)C(O)C(O)C(O5)OC(C(=O)3)=C(c(c4)ccc(O)c(O)4)Oc(c31)cc(OC(C(O)2)OC(C(C2OC(C)=O)OC(C)=O)C)c(OC)c1O)C(C)=O | + | SMILES O(C(C5C)C(O)C(O)C(O5)OC(C(=O)3)=C(c(c4)ccc(O)c(O)4)Oc(c31)cc(OC(C(O)2)OC(C(C2OC(C)=O)OC(C)=O)C)c(OC)c1O)C(C)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
53 57 0 0 0 0 0 0 0 0999 V2000
-1.1636 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1636 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4492 -0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2653 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2653 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4492 0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9797 -0.9929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6942 -0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6942 0.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9797 0.6572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9811 -1.8437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5939 0.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3221 0.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0503 0.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0503 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3221 2.0771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5939 1.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4492 -1.8176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8296 2.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8830 0.6869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4281 -1.0310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1536 -2.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8412 -2.8180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6230 -2.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8412 -1.2864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1536 -0.8893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3718 -1.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2149 -1.6528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1665 -3.1433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 -3.4826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1588 -2.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3185 0.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 0.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8581 1.2842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 2.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3185 2.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1045 1.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8883 2.8576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 2.5236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6892 2.1281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9282 0.8945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8869 3.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2756 4.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4500 4.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3788 2.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7467 2.7307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8655 1.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3221 2.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4297 -3.5014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8655 -2.9744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7532 -4.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8693 -0.9878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9518 -1.5176 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
38 42 1 0 0 0 0
42 43 1 0 0 0 0
42 44 2 0 0 0 0
40 45 1 0 0 0 0
45 46 2 0 0 0 0
45 47 1 0 0 0 0
16 48 1 0 0 0 0
49 30 1 0 0 0 0
49 50 2 0 0 0 0
49 51 1 0 0 0 0
52 53 1 0 0 0 0
2 52 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 52 53
M SBL 1 1 57
M SMT 1 ^OCH3
M SBV 1 57 0.7057 0.4074
S SKP 5
ID FL5FECGS0050
FORMULA C34H38O19
EXACTMASS 750.200729034
AVERAGEMASS 750.6541199999999
SMILES O(C(C5C)C(O)C(O)C(O5)OC(C(=O)3)=C(c(c4)ccc(O)c(O)4)Oc(c31)cc(OC(C(O)2)OC(C(C2OC(C)=O)OC(C)=O)C)c(OC)c1O)C(C)=O
M END
