Mol:FL5FFCGS0018
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 46 50 0 0 0 0 0 0 0 0999 V2000 | + | 46 50 0 0 0 0 0 0 0 0999 V2000 |
| − | -0.7793 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7793 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7793 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7793 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0647 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0647 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6498 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6498 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6498 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6498 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0647 -0.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0647 -0.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3643 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3643 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0789 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0789 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0789 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0789 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3643 -0.3077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3643 -0.3077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3643 -2.6907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3643 -2.6907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9786 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9786 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7068 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7068 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4351 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4351 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4351 0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4351 0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7068 1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7068 1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9786 0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9786 0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0647 -2.7825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0647 -2.7825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.1090 1.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1090 1.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4151 -0.3077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4151 -0.3077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8024 -2.0712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8024 -2.0712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9894 -0.2741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9894 -0.2741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5024 -0.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5024 -0.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8011 -0.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8011 -0.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0703 -0.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0703 -0.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6162 -0.1450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6162 -0.1450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3325 -0.4023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3325 -0.4023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5941 -0.4768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5941 -0.4768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2764 -0.8804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2764 -0.8804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1092 -1.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1092 -1.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3318 -1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3318 -1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6978 -2.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6978 -2.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9938 -2.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9938 -2.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2855 -2.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2855 -2.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9193 -1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9193 -1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6234 -1.9761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6234 -1.9761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2020 -1.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2020 -1.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3288 -2.2644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3288 -2.2644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.4016 -2.8586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4016 -2.8586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2855 -3.0269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2855 -3.0269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0647 0.4455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0647 0.4455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4959 1.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4959 1.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7068 1.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7068 1.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2737 3.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2737 3.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8597 0.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8597 0.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.1090 0.3788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.1090 0.3788 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 |
| − | 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 |
| − | 20 1 1 0 0 0 0 | + | 20 1 1 0 0 0 0 |
| − | 21 8 1 0 0 0 0 | + | 21 8 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 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 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 |
| − | 22 28 1 0 0 0 0 | + | 22 28 1 0 0 0 0 |
| − | 23 29 1 0 0 0 0 | + | 23 29 1 0 0 0 0 |
| − | 24 30 1 0 0 0 0 | + | 24 30 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 33 1 1 0 0 0 | + | 32 33 1 1 0 0 0 |
| − | 33 34 1 1 0 0 0 | + | 33 34 1 1 0 0 0 |
| − | 35 34 1 1 0 0 0 | + | 35 34 1 1 0 0 0 |
| − | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
| − | 36 31 1 0 0 0 0 | + | 36 31 1 0 0 0 0 |
| − | 31 37 1 0 0 0 0 | + | 31 37 1 0 0 0 0 |
| − | 32 38 1 0 0 0 0 | + | 32 38 1 0 0 0 0 |
| − | 33 39 1 0 0 0 0 | + | 33 39 1 0 0 0 0 |
| − | 34 40 1 0 0 0 0 | + | 34 40 1 0 0 0 0 |
| − | 35 30 1 0 0 0 0 | + | 35 30 1 0 0 0 0 |
| − | 25 20 1 0 0 0 0 | + | 25 20 1 0 0 0 0 |
| − | 41 42 1 0 0 0 0 | + | 41 42 1 0 0 0 0 |
| − | 6 41 1 0 0 0 0 | + | 6 41 1 0 0 0 0 |
| − | 43 44 1 0 0 0 0 | + | 43 44 1 0 0 0 0 |
| − | 16 43 1 0 0 0 0 | + | 16 43 1 0 0 0 0 |
| − | 45 46 1 0 0 0 0 | + | 45 46 1 0 0 0 0 |
| − | 27 45 1 0 0 0 0 | + | 27 45 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 41 42 | + | M SAL 1 2 41 42 |
| − | M SBL 1 1 46 | + | M SBL 1 1 46 |
| − | M SMT 1 OCH3 | + | M SMT 1 OCH3 |
| − | M SBV 1 46 0.0000 -0.7531 | + | M SBV 1 46 0.0000 -0.7531 |
| − | M STY 1 2 SUP | + | M STY 1 2 SUP |
| − | M SLB 1 2 2 | + | M SLB 1 2 2 |
| − | M SAL 2 2 43 44 | + | M SAL 2 2 43 44 |
| − | M SBL 2 1 48 | + | M SBL 2 1 48 |
| − | M SMT 2 OCH3 | + | M SMT 2 OCH3 |
| − | M SBV 2 48 0.0000 -0.7618 | + | M SBV 2 48 0.0000 -0.7618 |
| − | M STY 1 3 SUP | + | M STY 1 3 SUP |
| − | M SLB 1 3 3 | + | M SLB 1 3 3 |
| − | M SAL 3 2 45 46 | + | M SAL 3 2 45 46 |
| − | M SBL 3 1 50 | + | M SBL 3 1 50 |
| − | M SMT 3 ^ CH2OH | + | M SMT 3 ^ CH2OH |
| − | M SBV 3 50 0.5272 -0.4826 | + | M SBV 3 50 0.5272 -0.4826 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL5FFCGS0018 | + | ID FL5FFCGS0018 |
| − | FORMULA C29H34O17 | + | FORMULA C29H34O17 |
| − | EXACTMASS 654.179599662 | + | EXACTMASS 654.179599662 |
| − | AVERAGEMASS 654.57006 | + | AVERAGEMASS 654.57006 |
| − | SMILES c(c43)(O)cc(c(c3OC(c(c5)cc(c(O)c5)OC)=C(C4=O)O)OC)OC(O1)C(OC(O2)C(C(C(C2C)O)O)O)C(O)C(C1CO)O | + | SMILES c(c43)(O)cc(c(c3OC(c(c5)cc(c(O)c5)OC)=C(C4=O)O)OC)OC(O1)C(OC(O2)C(C(C(C2C)O)O)O)C(O)C(C1CO)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
46 50 0 0 0 0 0 0 0 0999 V2000
-0.7793 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7793 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0647 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6498 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6498 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0647 -0.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3643 -1.9578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0789 -1.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0789 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3643 -0.3077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3643 -2.6907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9786 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7068 -0.5693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4351 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4351 0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7068 1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9786 0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0647 -2.7825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1090 1.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4151 -0.3077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8024 -2.0712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9894 -0.2741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5024 -0.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8011 -0.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0703 -0.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6162 -0.1450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3325 -0.4023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5941 -0.4768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2764 -0.8804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1092 -1.0931 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3318 -1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6978 -2.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9938 -2.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2855 -2.4091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9193 -1.7749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6234 -1.9761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2020 -1.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3288 -2.2644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4016 -2.8586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2855 -3.0269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0647 0.4455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4959 1.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7068 1.8743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2737 3.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8597 0.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1090 0.3788 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
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
20 1 1 0 0 0 0
21 8 1 0 0 0 0
4 3 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 27 1 0 0 0 0
27 22 1 0 0 0 0
22 28 1 0 0 0 0
23 29 1 0 0 0 0
24 30 1 0 0 0 0
31 32 1 0 0 0 0
32 33 1 1 0 0 0
33 34 1 1 0 0 0
35 34 1 1 0 0 0
35 36 1 0 0 0 0
36 31 1 0 0 0 0
31 37 1 0 0 0 0
32 38 1 0 0 0 0
33 39 1 0 0 0 0
34 40 1 0 0 0 0
35 30 1 0 0 0 0
25 20 1 0 0 0 0
41 42 1 0 0 0 0
6 41 1 0 0 0 0
43 44 1 0 0 0 0
16 43 1 0 0 0 0
45 46 1 0 0 0 0
27 45 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 41 42
M SBL 1 1 46
M SMT 1 OCH3
M SBV 1 46 0.0000 -0.7531
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 43 44
M SBL 2 1 48
M SMT 2 OCH3
M SBV 2 48 0.0000 -0.7618
M STY 1 3 SUP
M SLB 1 3 3
M SAL 3 2 45 46
M SBL 3 1 50
M SMT 3 ^ CH2OH
M SBV 3 50 0.5272 -0.4826
S SKP 5
ID FL5FFCGS0018
FORMULA C29H34O17
EXACTMASS 654.179599662
AVERAGEMASS 654.57006
SMILES c(c43)(O)cc(c(c3OC(c(c5)cc(c(O)c5)OC)=C(C4=O)O)OC)OC(O1)C(OC(O2)C(C(C(C2C)O)O)O)C(O)C(C1CO)O
M END
