Mol:FL7AACGA0013
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 |
| − | -2.8728 1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8728 1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1320 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1320 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1320 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1320 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8728 3.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8728 3.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6136 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6136 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6136 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6136 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3911 1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3911 1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6503 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6503 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6503 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6503 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3911 3.1060 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 | + | -1.3911 3.1060 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0553 3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0553 3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7636 2.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7636 2.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4718 3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4718 3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4718 3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4718 3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7636 4.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7636 4.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0553 3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0553 3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7636 4.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7636 4.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0564 4.2410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0564 4.2410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2197 3.0282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2197 3.0282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8728 0.7945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8728 0.7945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1856 1.3463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1856 1.3463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2794 0.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2794 0.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2789 0.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2789 0.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9710 -0.2427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9710 -0.2427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1978 -1.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1978 -1.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1983 -1.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1983 -1.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5062 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5062 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8044 0.9957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8044 0.9957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1740 -0.7023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1740 -0.7023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9464 -0.7054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9464 -0.7054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8666 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8666 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7376 -2.3148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7376 -2.3148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2243 -3.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2243 -3.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1215 -4.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1215 -4.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7803 -3.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7803 -3.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7779 -4.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7779 -4.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1239 -3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1239 -3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2219 -3.5342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2219 -3.5342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5499 -3.9021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5499 -3.9021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8689 -4.3384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8689 -4.3384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3880 -4.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3880 -4.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8718 -4.7747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8718 -4.7747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2788 1.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2788 1.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6968 2.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6968 2.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0168 1.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0168 1.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5995 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5995 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3953 1.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3953 1.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6085 2.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6085 2.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0259 2.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0259 2.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2300 2.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2300 2.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2043 3.3948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2043 3.3948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2197 2.1468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2197 2.1468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8048 0.9415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8048 0.9415 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 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 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 3 1 0 0 0 0 | + | 10 3 1 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 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 11 1 0 0 0 0 | + | 16 11 1 0 0 0 0 |
| − | 15 17 1 0 0 0 0 | + | 15 17 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 5 19 1 0 0 0 0 | + | 5 19 1 0 0 0 0 |
| − | 1 20 1 0 0 0 0 | + | 1 20 1 0 0 0 0 |
| − | 8 21 1 0 0 0 0 | + | 8 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 |
| − | 22 28 1 0 0 0 0 | + | 22 28 1 0 0 0 0 |
| − | 27 29 1 0 0 0 0 | + | 27 29 1 0 0 0 0 |
| − | 26 30 1 0 0 0 0 | + | 26 30 1 0 0 0 0 |
| − | 25 31 1 0 0 0 0 | + | 25 31 1 0 0 0 0 |
| − | 21 23 1 0 0 0 0 | + | 21 23 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
| − | 34 35 1 1 0 0 0 | + | 34 35 1 1 0 0 0 |
| − | 36 35 1 1 0 0 0 | + | 36 35 1 1 0 0 0 |
| − | 37 36 1 1 0 0 0 | + | 37 36 1 1 0 0 0 |
| − | 37 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
| − | 38 33 1 0 0 0 0 | + | 38 33 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 41 1 0 0 0 0 | + | 35 41 1 0 0 0 0 |
| − | 36 42 1 0 0 0 0 | + | 36 42 1 0 0 0 0 |
| − | 37 32 1 0 0 0 0 | + | 37 32 1 0 0 0 0 |
| − | 28 43 1 0 0 0 0 | + | 28 43 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 |
| − | 45 46 2 0 0 0 0 | + | 45 46 2 0 0 0 0 |
| − | 46 47 1 0 0 0 0 | + | 46 47 1 0 0 0 0 |
| − | 47 48 2 0 0 0 0 | + | 47 48 2 0 0 0 0 |
| − | 48 49 1 0 0 0 0 | + | 48 49 1 0 0 0 0 |
| − | 49 50 2 0 0 0 0 | + | 49 50 2 0 0 0 0 |
| − | 50 45 1 0 0 0 0 | + | 50 45 1 0 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 |
| − | 47 53 1 0 0 0 0 | + | 47 53 1 0 0 0 0 |
| − | M CHG 1 10 1 | + | M CHG 1 10 1 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL7AACGA0013 | + | ID FL7AACGA0013 |
| − | FORMULA C34H35O19 | + | FORMULA C34H35O19 |
| − | EXACTMASS 747.1772539379999 | + | EXACTMASS 747.1772539379999 |
| − | AVERAGEMASS 747.6303 | + | AVERAGEMASS 747.6303 |
| − | SMILES O(C(COC(C(O)6)OC(C(O)C6O)C)2)C(Oc(c(c(c5)ccc(c5O)O)3)cc(c4O)c(cc(c4)O)[o+1]3)C(C(O)C(O)2)OC(c(c1)cc(O)c(O)c1O)=O | + | SMILES O(C(COC(C(O)6)OC(C(O)C6O)C)2)C(Oc(c(c(c5)ccc(c5O)O)3)cc(c4O)c(cc(c4)O)[o+1]3)C(C(O)C(O)2)OC(c(c1)cc(O)c(O)c1O)=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
-2.8728 1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1320 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1320 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8728 3.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6136 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6136 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3911 1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6503 1.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6503 2.6783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3911 3.1060 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
0.0553 3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7636 2.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4718 3.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4718 3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7636 4.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0553 3.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7636 4.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0564 4.2410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2197 3.0282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8728 0.7945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1856 1.3463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2794 0.4419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2789 0.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9710 -0.2427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1978 -1.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1983 -1.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5062 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8044 0.9957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1740 -0.7023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9464 -0.7054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8666 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7376 -2.3148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2243 -3.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1215 -4.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7803 -3.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7779 -4.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1239 -3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2219 -3.5342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5499 -3.9021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8689 -4.3384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3880 -4.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8718 -4.7747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2788 1.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6968 2.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0168 1.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5995 1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3953 1.3509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6085 2.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0259 2.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2300 2.5161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2043 3.3948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2197 2.1468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8048 0.9415 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
2 7 1 0 0 0 0
7 8 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 3 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 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 11 1 0 0 0 0
15 17 1 0 0 0 0
14 18 1 0 0 0 0
5 19 1 0 0 0 0
1 20 1 0 0 0 0
8 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
22 28 1 0 0 0 0
27 29 1 0 0 0 0
26 30 1 0 0 0 0
25 31 1 0 0 0 0
21 23 1 0 0 0 0
31 32 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
37 36 1 1 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
33 39 1 0 0 0 0
34 40 1 0 0 0 0
35 41 1 0 0 0 0
36 42 1 0 0 0 0
37 32 1 0 0 0 0
28 43 1 0 0 0 0
43 44 2 0 0 0 0
43 45 1 0 0 0 0
45 46 2 0 0 0 0
46 47 1 0 0 0 0
47 48 2 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
50 45 1 0 0 0 0
49 51 1 0 0 0 0
48 52 1 0 0 0 0
47 53 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AACGA0013
FORMULA C34H35O19
EXACTMASS 747.1772539379999
AVERAGEMASS 747.6303
SMILES O(C(COC(C(O)6)OC(C(O)C6O)C)2)C(Oc(c(c(c5)ccc(c5O)O)3)cc(c4O)c(cc(c4)O)[o+1]3)C(C(O)C(O)2)OC(c(c1)cc(O)c(O)c1O)=O
M END
