Mol:FL5FAGGL0009
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 54 59 0 0 0 0 0 0 0 0999 V2000 | + | 54 59 0 0 0 0 0 0 0 0999 V2000 |
| − | -2.0900 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0900 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0900 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0900 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3789 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3789 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6679 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6679 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6679 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6679 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3789 0.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3789 0.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0431 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0431 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7541 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7541 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7541 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7541 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0431 0.8954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0431 0.8954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0431 -1.3868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0431 -1.3868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4649 0.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4649 0.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1894 0.4768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1894 0.4768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9141 0.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9141 0.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9141 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9141 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1894 2.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1894 2.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4649 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4649 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8007 0.8953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8007 0.8953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4448 -0.7726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4448 -0.7726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3789 -1.5674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3789 -1.5674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4009 -2.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4009 -2.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9718 -2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9718 -2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7970 -2.6404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7970 -2.6404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6271 -2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6271 -2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0988 -2.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0988 -2.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2310 -2.3688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2310 -2.3688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6040 -2.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6040 -2.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6382 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6382 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2091 -0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2091 -0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0342 -0.7438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0342 -0.7438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8644 -0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8644 -0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2935 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2935 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4683 -0.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4683 -0.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7601 -0.3482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7601 -0.3482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9538 0.0736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9538 0.0736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9421 -0.3686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9421 -0.3686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4977 -0.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4977 -0.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.9223 -1.3937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9223 -1.3937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4368 -2.7328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4368 -2.7328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2597 -3.3453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2597 -3.3453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6285 -3.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6285 -3.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7243 2.1999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7243 2.1999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1894 2.9869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1894 2.9869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6386 0.4770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6386 0.4770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4219 1.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4219 1.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6190 0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6190 0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8737 1.6476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8737 1.6476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6190 2.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6190 2.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4219 3.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4219 3.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1671 2.1166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1671 2.1166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0734 3.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0734 3.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6176 3.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6176 3.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8055 2.6801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8055 2.6801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.0988 1.1810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0988 1.1810 0.0000 O 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 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 8 19 1 0 0 0 0 | + | 8 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | 22 23 1 1 0 0 0 | + | 22 23 1 1 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 |
| − | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
| − | 26 21 1 0 0 0 0 | + | 26 21 1 0 0 0 0 |
| − | 21 27 1 0 0 0 0 | + | 21 27 1 0 0 0 0 |
| − | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
| − | 29 30 1 1 0 0 0 | + | 29 30 1 1 0 0 0 |
| − | 30 31 1 1 0 0 0 | + | 30 31 1 1 0 0 0 |
| − | 32 31 1 1 0 0 0 | + | 32 31 1 1 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 33 28 1 0 0 0 0 | + | 33 28 1 0 0 0 0 |
| − | 28 34 1 0 0 0 0 | + | 28 34 1 0 0 0 0 |
| − | 33 35 1 0 0 0 0 | + | 33 35 1 0 0 0 0 |
| − | 32 36 1 0 0 0 0 | + | 32 36 1 0 0 0 0 |
| − | 31 37 1 0 0 0 0 | + | 31 37 1 0 0 0 0 |
| − | 25 38 1 0 0 0 0 | + | 25 38 1 0 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 22 39 1 0 0 0 0 | + | 22 39 1 0 0 0 0 |
| − | 23 40 1 0 0 0 0 | + | 23 40 1 0 0 0 0 |
| − | 24 41 1 0 0 0 0 | + | 24 41 1 0 0 0 0 |
| − | 29 19 1 0 0 0 0 | + | 29 19 1 0 0 0 0 |
| − | 42 15 1 0 0 0 0 | + | 42 15 1 0 0 0 0 |
| − | 16 43 1 0 0 0 0 | + | 16 43 1 0 0 0 0 |
| − | 14 44 1 0 0 0 0 | + | 14 44 1 0 0 0 0 |
| − | 46 45 1 1 0 0 0 | + | 46 45 1 1 0 0 0 |
| − | 46 47 1 0 0 0 0 | + | 46 47 1 0 0 0 0 |
| − | 47 48 1 0 0 0 0 | + | 47 48 1 0 0 0 0 |
| − | 48 49 1 0 0 0 0 | + | 48 49 1 0 0 0 0 |
| − | 49 50 1 1 0 0 0 | + | 49 50 1 1 0 0 0 |
| − | 50 45 1 1 0 0 0 | + | 50 45 1 1 0 0 0 |
| − | 49 51 1 0 0 0 0 | + | 49 51 1 0 0 0 0 |
| − | 48 52 1 0 0 0 0 | + | 48 52 1 0 0 0 0 |
| − | 50 53 1 0 0 0 0 | + | 50 53 1 0 0 0 0 |
| − | 45 54 1 0 0 0 0 | + | 45 54 1 0 0 0 0 |
| − | 46 18 1 0 0 0 0 | + | 46 18 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FAGGL0009 | + | ID FL5FAGGL0009 |
| − | FORMULA C33H40O21 | + | FORMULA C33H40O21 |
| − | EXACTMASS 772.206208342 | + | EXACTMASS 772.206208342 |
| − | AVERAGEMASS 772.6581 | + | AVERAGEMASS 772.6581 |
| − | SMILES O=C(C(OC(C5O)OC(COC(C6O)OC(C(C6O)O)C)C(O)C5O)=3)c(c1OC3c(c4)cc(O)c(c(O)4)O)c(cc(OC(C(O)2)OC(C)C(C2O)O)c1)O | + | SMILES O=C(C(OC(C5O)OC(COC(C6O)OC(C(C6O)O)C)C(O)C5O)=3)c(c1OC3c(c4)cc(O)c(c(O)4)O)c(cc(OC(C(O)2)OC(C)C(C2O)O)c1)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
54 59 0 0 0 0 0 0 0 0999 V2000
-2.0900 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0900 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3789 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6679 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6679 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3789 0.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0431 -0.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7541 -0.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7541 0.4849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0431 0.8954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0431 -1.3868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4649 0.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1894 0.4768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9141 0.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9141 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1894 2.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4649 1.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8007 0.8953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4448 -0.7726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3789 -1.5674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4009 -2.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9718 -2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7970 -2.6404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6271 -2.8762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0988 -2.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2310 -2.3688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6040 -2.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6382 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2091 -0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0342 -0.7438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8644 -0.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2935 -0.2365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4683 -0.4722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7601 -0.3482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9538 0.0736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9421 -0.3686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4977 -0.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9223 -1.3937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4368 -2.7328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2597 -3.3453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6285 -3.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7243 2.1999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1894 2.9869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6386 0.4770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4219 1.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6190 0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8737 1.6476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6190 2.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4219 3.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1671 2.1166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0734 3.5810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6176 3.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8055 2.6801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0988 1.1810 0.0000 O 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
3 4 1 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
1 18 1 0 0 0 0
8 19 1 0 0 0 0
3 20 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
21 27 1 0 0 0 0
28 29 1 0 0 0 0
29 30 1 1 0 0 0
30 31 1 1 0 0 0
32 31 1 1 0 0 0
32 33 1 0 0 0 0
33 28 1 0 0 0 0
28 34 1 0 0 0 0
33 35 1 0 0 0 0
32 36 1 0 0 0 0
31 37 1 0 0 0 0
25 38 1 0 0 0 0
37 38 1 0 0 0 0
22 39 1 0 0 0 0
23 40 1 0 0 0 0
24 41 1 0 0 0 0
29 19 1 0 0 0 0
42 15 1 0 0 0 0
16 43 1 0 0 0 0
14 44 1 0 0 0 0
46 45 1 1 0 0 0
46 47 1 0 0 0 0
47 48 1 0 0 0 0
48 49 1 0 0 0 0
49 50 1 1 0 0 0
50 45 1 1 0 0 0
49 51 1 0 0 0 0
48 52 1 0 0 0 0
50 53 1 0 0 0 0
45 54 1 0 0 0 0
46 18 1 0 0 0 0
S SKP 5
ID FL5FAGGL0009
FORMULA C33H40O21
EXACTMASS 772.206208342
AVERAGEMASS 772.6581
SMILES O=C(C(OC(C5O)OC(COC(C6O)OC(C(C6O)O)C)C(O)C5O)=3)c(c1OC3c(c4)cc(O)c(c(O)4)O)c(cc(OC(C(O)2)OC(C)C(C2O)O)c1)O
M END
