Mol:FL5FAAGS0135
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 58 0 0 0 0 0 0 0 0999 V2000 | + | 53 58 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.8431 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8431 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8431 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8431 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5575 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5575 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2720 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2720 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2720 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2720 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5575 3.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5575 3.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1286 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1286 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4142 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4142 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6997 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6997 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6997 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6997 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4142 0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4142 0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1286 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1286 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0147 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0147 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7292 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7292 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7292 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7292 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0147 0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0147 0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4142 0.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4142 0.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4437 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4437 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8062 0.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8062 0.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8727 3.7908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8727 3.7908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0147 0.2695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0147 0.2695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0065 1.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0065 1.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4192 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4192 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6257 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6257 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8274 1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8274 1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4146 1.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4146 1.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2082 1.6431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2082 1.6431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8113 0.4779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8113 0.4779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0653 0.7529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0653 0.7529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9736 1.4395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9736 1.4395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6378 1.8107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6378 1.8107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5897 1.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5897 1.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8293 1.8544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8293 1.8544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8727 0.9494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8727 0.9494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6200 -0.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6200 -0.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4630 -1.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4630 -1.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1392 -0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1392 -0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9621 -0.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9621 -0.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1192 0.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1192 0.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4429 -0.1379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4429 -0.1379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1835 -1.0475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1835 -1.0475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8765 -1.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8765 -1.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9940 -0.9954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9940 -0.9954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0344 -0.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0344 -0.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6692 -3.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6692 -3.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4902 -3.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4902 -3.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6249 -2.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6249 -2.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1558 -1.7221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1558 -1.7221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3349 -1.8071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3349 -1.8071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2001 -2.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2001 -2.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3981 -2.2738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3981 -2.2738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0589 -3.6876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0589 -3.6876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4634 -3.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4634 -3.8564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
| − | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 16 21 1 0 0 0 0 | + | 16 21 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 23 24 1 1 0 0 0 | + | 23 24 1 1 0 0 0 |
| − | 25 24 1 1 0 0 0 | + | 25 24 1 1 0 0 0 |
| − | 26 25 1 1 0 0 0 | + | 26 25 1 1 0 0 0 |
| − | 26 27 1 0 0 0 0 | + | 26 27 1 0 0 0 0 |
| − | 27 22 1 0 0 0 0 | + | 27 22 1 0 0 0 0 |
| − | 25 28 1 0 0 0 0 | + | 25 28 1 0 0 0 0 |
| − | 24 29 1 0 0 0 0 | + | 24 29 1 0 0 0 0 |
| − | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
| − | 22 31 1 0 0 0 0 | + | 22 31 1 0 0 0 0 |
| − | 26 18 1 0 0 0 0 | + | 26 18 1 0 0 0 0 |
| − | 30 32 1 0 0 0 0 | + | 30 32 1 0 0 0 0 |
| − | 32 33 2 0 0 0 0 | + | 32 33 2 0 0 0 0 |
| − | 32 34 1 0 0 0 0 | + | 32 34 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 |
| − | 38 37 1 1 0 0 0 | + | 38 37 1 1 0 0 0 |
| − | 39 38 1 1 0 0 0 | + | 39 38 1 1 0 0 0 |
| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
| − | 40 35 1 0 0 0 0 | + | 40 35 1 0 0 0 0 |
| − | 38 41 1 0 0 0 0 | + | 38 41 1 0 0 0 0 |
| − | 37 42 1 0 0 0 0 | + | 37 42 1 0 0 0 0 |
| − | 36 43 1 0 0 0 0 | + | 36 43 1 0 0 0 0 |
| − | 35 44 1 0 0 0 0 | + | 35 44 1 0 0 0 0 |
| − | 39 19 1 0 0 0 0 | + | 39 19 1 0 0 0 0 |
| − | 45 46 1 1 0 0 0 | + | 45 46 1 1 0 0 0 |
| − | 46 47 1 1 0 0 0 | + | 46 47 1 1 0 0 0 |
| − | 48 47 1 1 0 0 0 | + | 48 47 1 1 0 0 0 |
| − | 48 49 1 0 0 0 0 | + | 48 49 1 0 0 0 0 |
| − | 49 50 1 0 0 0 0 | + | 49 50 1 0 0 0 0 |
| − | 50 45 1 0 0 0 0 | + | 50 45 1 0 0 0 0 |
| − | 47 51 1 0 0 0 0 | + | 47 51 1 0 0 0 0 |
| − | 46 52 1 0 0 0 0 | + | 46 52 1 0 0 0 0 |
| − | 45 53 1 0 0 0 0 | + | 45 53 1 0 0 0 0 |
| − | 48 41 1 0 0 0 0 | + | 48 41 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FAAGS0135 | + | ID FL5FAAGS0135 |
| − | FORMULA C34H40O19 | + | FORMULA C34H40O19 |
| − | EXACTMASS 752.216379098 | + | EXACTMASS 752.216379098 |
| − | AVERAGEMASS 752.67 | + | AVERAGEMASS 752.67 |
| − | SMILES c(c5)(c(C(=O)1)c(cc5OC(O6)C(O)C(C(C6C)OC(C)=O)O)OC(c(c4)ccc(c4)O)=C1OC(C(OC(C3O)OCC(C3O)O)2)OC(C(O)C2O)C)O | + | SMILES c(c5)(c(C(=O)1)c(cc5OC(O6)C(O)C(C(C6C)OC(C)=O)O)OC(c(c4)ccc(c4)O)=C1OC(C(OC(C3O)OCC(C3O)O)2)OC(C(O)C2O)C)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
2.8431 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8431 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5575 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2720 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2720 3.4439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5575 3.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1286 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4142 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6997 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6997 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4142 0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1286 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0147 2.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7292 2.2064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7292 1.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0147 0.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4142 0.2508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4437 2.6189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8062 0.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8727 3.7908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0147 0.2695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0065 1.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4192 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6257 1.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8274 1.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4146 1.8699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2082 1.6431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8113 0.4779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0653 0.7529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9736 1.4395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6378 1.8107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5897 1.4395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8293 1.8544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8727 0.9494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6200 -0.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4630 -1.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1392 -0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9621 -0.4751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1192 0.3350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4429 -0.1379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1835 -1.0475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8765 -1.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9940 -0.9954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0344 -0.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6692 -3.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4902 -3.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6249 -2.3539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1558 -1.7221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3349 -1.8071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2001 -2.6212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3981 -2.2738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0589 -3.6876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4634 -3.8564 0.0000 O 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
5 20 1 0 0 0 0
16 21 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
26 25 1 1 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
25 28 1 0 0 0 0
24 29 1 0 0 0 0
23 30 1 0 0 0 0
22 31 1 0 0 0 0
26 18 1 0 0 0 0
30 32 1 0 0 0 0
32 33 2 0 0 0 0
32 34 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 1 0 0 0
38 37 1 1 0 0 0
39 38 1 1 0 0 0
39 40 1 0 0 0 0
40 35 1 0 0 0 0
38 41 1 0 0 0 0
37 42 1 0 0 0 0
36 43 1 0 0 0 0
35 44 1 0 0 0 0
39 19 1 0 0 0 0
45 46 1 1 0 0 0
46 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 45 1 0 0 0 0
47 51 1 0 0 0 0
46 52 1 0 0 0 0
45 53 1 0 0 0 0
48 41 1 0 0 0 0
S SKP 5
ID FL5FAAGS0135
FORMULA C34H40O19
EXACTMASS 752.216379098
AVERAGEMASS 752.67
SMILES c(c5)(c(C(=O)1)c(cc5OC(O6)C(O)C(C(C6C)OC(C)=O)O)OC(c(c4)ccc(c4)O)=C1OC(C(OC(C3O)OCC(C3O)O)2)OC(C(O)C2O)C)O
M END
