Mol:FL7AAGGA0005
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 |
| − | -2.3680 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3680 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3680 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3680 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6532 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6532 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9385 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9385 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9385 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9385 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6532 1.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6532 1.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2237 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2237 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4910 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4910 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4910 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4910 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2237 1.8621 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 | + | -0.2237 1.8621 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2055 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2055 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9341 1.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9341 1.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6626 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6626 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6626 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6626 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9341 3.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9341 3.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2055 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2055 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9341 3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9341 3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0825 1.8620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0825 1.8620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3908 3.1237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3908 3.1237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6532 -0.6135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6532 -0.6135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3908 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3908 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.8429 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8429 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1875 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1875 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5247 -1.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5247 -1.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8580 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8580 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5133 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5133 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1761 -1.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1761 -1.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5869 -1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5869 -1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0735 -2.4061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0735 -2.4061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8580 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8580 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3610 0.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3610 0.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5107 -2.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5107 -2.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2749 -3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2749 -3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8947 -3.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8947 -3.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5842 -3.3415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5842 -3.3415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8201 -2.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8201 -2.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2003 -2.9953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2003 -2.9953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8093 -3.0798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8093 -3.0798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2265 -0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2265 -0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6296 -0.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6296 -0.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2983 -0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2983 -0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7810 -1.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7810 -1.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3780 -0.7097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3780 -0.7097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7093 -0.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7093 -0.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8220 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8220 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1184 -0.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1184 -0.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5826 0.0534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5826 0.0534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4986 -1.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4986 -1.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6684 -1.9529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6684 -1.9529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6132 -3.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6132 -3.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6420 -3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6420 -3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6453 -3.9364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6453 -3.9364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8201 -1.7150 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8201 -1.7150 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 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 5 1 0 0 0 0 | + | 10 5 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 |
| − | 1 18 1 0 0 0 0 | + | 1 18 1 0 0 0 0 |
| − | 14 19 1 0 0 0 0 | + | 14 19 1 0 0 0 0 |
| − | 3 20 1 0 0 0 0 | + | 3 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 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 |
| − | 24 25 1 1 0 0 0 | + | 24 25 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 |
| − | 24 29 1 0 0 0 0 | + | 24 29 1 0 0 0 0 |
| − | 25 30 1 0 0 0 0 | + | 25 30 1 0 0 0 0 |
| − | 20 26 1 0 0 0 0 | + | 20 26 1 0 0 0 0 |
| − | 31 8 1 0 0 0 0 | + | 31 8 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 33 34 1 1 0 0 0 | + | 33 34 1 1 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 |
| − | 36 37 1 0 0 0 0 | + | 36 37 1 0 0 0 0 |
| − | 37 32 1 0 0 0 0 | + | 37 32 1 0 0 0 0 |
| − | 32 38 1 0 0 0 0 | + | 32 38 1 0 0 0 0 |
| − | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
| − | 40 41 1 1 0 0 0 | + | 40 41 1 1 0 0 0 |
| − | 41 42 1 1 0 0 0 | + | 41 42 1 1 0 0 0 |
| − | 43 42 1 1 0 0 0 | + | 43 42 1 1 0 0 0 |
| − | 43 44 1 0 0 0 0 | + | 43 44 1 0 0 0 0 |
| − | 44 39 1 0 0 0 0 | + | 44 39 1 0 0 0 0 |
| − | 39 45 1 0 0 0 0 | + | 39 45 1 0 0 0 0 |
| − | 44 46 1 0 0 0 0 | + | 44 46 1 0 0 0 0 |
| − | 43 47 1 0 0 0 0 | + | 43 47 1 0 0 0 0 |
| − | 42 48 1 0 0 0 0 | + | 42 48 1 0 0 0 0 |
| − | 36 49 1 0 0 0 0 | + | 36 49 1 0 0 0 0 |
| − | 48 49 1 0 0 0 0 | + | 48 49 1 0 0 0 0 |
| − | 33 50 1 0 0 0 0 | + | 33 50 1 0 0 0 0 |
| − | 34 51 1 0 0 0 0 | + | 34 51 1 0 0 0 0 |
| − | 35 52 1 0 0 0 0 | + | 35 52 1 0 0 0 0 |
| − | 40 31 1 0 0 0 0 | + | 40 31 1 0 0 0 0 |
| − | 23 53 1 0 0 0 0 | + | 23 53 1 0 0 0 0 |
| − | M CHG 1 10 1 | + | M CHG 1 10 1 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID FL7AAGGA0005 | + | ID FL7AAGGA0005 |
| − | FORMULA C33H41O20 | + | FORMULA C33H41O20 |
| − | EXACTMASS 757.219118752 | + | EXACTMASS 757.219118752 |
| − | AVERAGEMASS 757.6666399999999 | + | AVERAGEMASS 757.6666399999999 |
| − | SMILES C(O1)(Oc(c6)c(c2)c(cc6O)[o+1]c(c(c5)cc(O)c(c(O)5)O)c2OC(C4O)OC(C(C4O)O)COC(C3O)OC(C(O)C(O)3)C)C(C(C(C1C)O)O)O | + | SMILES C(O1)(Oc(c6)c(c2)c(cc6O)[o+1]c(c(c5)cc(O)c(c(O)5)O)c2OC(C4O)OC(C(C4O)O)COC(C3O)OC(C(O)C(O)3)C)C(C(C(C1C)O)O)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
-2.3680 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3680 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6532 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9385 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9385 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6532 1.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2237 0.2115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4910 0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4910 1.4495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2237 1.8621 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0
1.2055 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9341 1.4415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6626 1.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6626 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9341 3.1238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2055 2.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9341 3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0825 1.8620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3908 3.1237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6532 -0.6135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3908 1.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8429 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1875 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5247 -1.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8580 -1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5133 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1761 -1.5765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5869 -1.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0735 -2.4061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8580 -2.5657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3610 0.1548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5107 -2.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2749 -3.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8947 -3.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5842 -3.3415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8201 -2.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2003 -2.9953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8093 -3.0798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2265 -0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6296 -0.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2983 -0.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7810 -1.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3780 -0.7097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7093 -0.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8220 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1184 -0.2861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5826 0.0534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4986 -1.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6684 -1.9529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6132 -3.4663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6420 -3.9648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6453 -3.9364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8201 -1.7150 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 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 5 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
1 18 1 0 0 0 0
14 19 1 0 0 0 0
3 20 1 0 0 0 0
13 21 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 1 0 0 0
24 25 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
24 29 1 0 0 0 0
25 30 1 0 0 0 0
20 26 1 0 0 0 0
31 8 1 0 0 0 0
32 33 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 32 1 0 0 0 0
32 38 1 0 0 0 0
39 40 1 0 0 0 0
40 41 1 1 0 0 0
41 42 1 1 0 0 0
43 42 1 1 0 0 0
43 44 1 0 0 0 0
44 39 1 0 0 0 0
39 45 1 0 0 0 0
44 46 1 0 0 0 0
43 47 1 0 0 0 0
42 48 1 0 0 0 0
36 49 1 0 0 0 0
48 49 1 0 0 0 0
33 50 1 0 0 0 0
34 51 1 0 0 0 0
35 52 1 0 0 0 0
40 31 1 0 0 0 0
23 53 1 0 0 0 0
M CHG 1 10 1
S SKP 5
ID FL7AAGGA0005
FORMULA C33H41O20
EXACTMASS 757.219118752
AVERAGEMASS 757.6666399999999
SMILES C(O1)(Oc(c6)c(c2)c(cc6O)[o+1]c(c(c5)cc(O)c(c(O)5)O)c2OC(C4O)OC(C(C4O)O)COC(C3O)OC(C(O)C(O)3)C)C(C(C(C1C)O)O)O
M END
