Mol:FL2FEAGI0001
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 47 51 0 0 0 0 0 0 0 0999 V2000 | + | 47 51 0 0 0 0 0 0 0 0999 V2000 |
− | -2.1035 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1035 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1035 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1035 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3888 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3888 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6741 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6741 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6741 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6741 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3888 1.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3888 1.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.0407 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0407 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7554 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7554 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7554 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7554 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.0407 1.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0407 1.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4699 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4699 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1983 1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1983 1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9268 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9268 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.9268 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9268 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.1983 2.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1983 2.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.4699 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4699 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.0407 -0.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0407 -0.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3888 -0.7457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3888 -0.7457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8180 1.7296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8180 1.7296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3888 2.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3888 2.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1033 3.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1033 3.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.1033 3.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1033 3.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8177 4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8177 4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3888 4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3888 4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8536 -1.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8536 -1.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5645 -1.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5645 -1.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3389 -2.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3389 -2.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.5645 -2.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5645 -2.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8536 -3.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8536 -3.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.0791 -2.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0791 -2.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9859 -1.0184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9859 -1.0184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6117 -2.8021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6117 -2.8021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9656 -3.9144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9656 -3.9144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3413 -3.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3413 -3.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1095 -3.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1095 -3.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4348 -4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4348 -4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.6489 -3.5086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6489 -3.5086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4348 -2.7550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4348 -2.7550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.1095 -2.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1095 -2.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8955 -3.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8955 -3.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.7974 -1.8572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7974 -1.8572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4348 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4348 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.5024 -2.9519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5024 -2.9519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.6550 -3.8682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6550 -3.8682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7537 -4.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7537 -4.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8180 0.0794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8180 0.0794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.6550 2.9914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6550 2.9914 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 1 0 0 0 0 | + | 8 9 1 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 |
− | 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 |
− | 7 17 2 0 0 0 0 | + | 7 17 2 0 0 0 0 |
− | 3 18 1 0 0 0 0 | + | 3 18 1 0 0 0 0 |
− | 1 19 1 0 0 0 0 | + | 1 19 1 0 0 0 0 |
− | 6 20 1 0 0 0 0 | + | 6 20 1 0 0 0 0 |
− | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
− | 21 22 2 0 0 0 0 | + | 21 22 2 0 0 0 0 |
− | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
− | 22 24 1 0 0 0 0 | + | 22 24 1 0 0 0 0 |
− | 25 26 1 0 0 0 0 | + | 25 26 1 0 0 0 0 |
− | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
− | 27 28 1 1 0 0 0 | + | 27 28 1 1 0 0 0 |
− | 29 28 1 1 0 0 0 | + | 29 28 1 1 0 0 0 |
− | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
− | 30 25 1 0 0 0 0 | + | 30 25 1 0 0 0 0 |
− | 25 31 1 0 0 0 0 | + | 25 31 1 0 0 0 0 |
− | 30 32 1 0 0 0 0 | + | 30 32 1 0 0 0 0 |
− | 29 33 1 0 0 0 0 | + | 29 33 1 0 0 0 0 |
− | 28 34 1 0 0 0 0 | + | 28 34 1 0 0 0 0 |
− | 18 26 1 0 0 0 0 | + | 18 26 1 0 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 38 1 0 0 0 0 | + | 37 38 1 0 0 0 0 |
− | 38 39 1 0 0 0 0 | + | 38 39 1 0 0 0 0 |
− | 39 40 1 1 0 0 0 | + | 39 40 1 1 0 0 0 |
− | 40 35 1 1 0 0 0 | + | 40 35 1 1 0 0 0 |
− | 39 41 1 0 0 0 0 | + | 39 41 1 0 0 0 0 |
− | 38 42 1 0 0 0 0 | + | 38 42 1 0 0 0 0 |
− | 40 43 1 0 0 0 0 | + | 40 43 1 0 0 0 0 |
− | 35 44 1 0 0 0 0 | + | 35 44 1 0 0 0 0 |
− | 36 45 1 0 0 0 0 | + | 36 45 1 0 0 0 0 |
− | 45 34 1 0 0 0 0 | + | 45 34 1 0 0 0 0 |
− | 2 46 1 0 0 0 0 | + | 2 46 1 0 0 0 0 |
− | 14 47 1 0 0 0 0 | + | 14 47 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID FL2FEAGI0001 | + | ID FL2FEAGI0001 |
− | FORMULA C32H40O15 | + | FORMULA C32H40O15 |
− | EXACTMASS 664.23672061 | + | EXACTMASS 664.23672061 |
− | AVERAGEMASS 664.651 | + | AVERAGEMASS 664.651 |
− | SMILES C(O)(C1Oc(c34)c(c(O)c(c(OC(c(c5)ccc(c5)O)CC4=O)3)CC=C(C)C)O)C(O)C(C(COC(C2O)OC(C(C(O)2)O)C)O1)O | + | SMILES C(O)(C1Oc(c34)c(c(O)c(c(OC(c(c5)ccc(c5)O)CC4=O)3)CC=C(C)C)O)C(O)C(C(COC(C2O)OC(C(C(O)2)O)C)O1)O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 47 51 0 0 0 0 0 0 0 0999 V2000 -2.1035 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1035 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6741 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6741 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 1.7299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0407 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7554 0.4919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7554 1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0407 1.7299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4699 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1983 1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9268 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9268 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1983 2.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4699 2.5709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0407 -0.6194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 -0.7457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 1.7296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 2.6079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1033 3.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1033 3.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8177 4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8536 -1.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5645 -1.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3389 -2.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5645 -2.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8536 -3.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0791 -2.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9859 -1.0184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6117 -2.8021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9656 -3.9144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3413 -3.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1095 -3.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4348 -4.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6489 -3.5086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4348 -2.7550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1095 -2.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8955 -3.1144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7974 -1.8572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4348 -2.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5024 -2.9519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -3.8682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7537 -4.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 0.0794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 2.9914 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 1 0 0 0 0 9 10 1 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 7 17 2 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 6 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 1 0 0 0 27 28 1 1 0 0 0 29 28 1 1 0 0 0 29 30 1 0 0 0 0 30 25 1 0 0 0 0 25 31 1 0 0 0 0 30 32 1 0 0 0 0 29 33 1 0 0 0 0 28 34 1 0 0 0 0 18 26 1 0 0 0 0 36 35 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 1 0 0 0 40 35 1 1 0 0 0 39 41 1 0 0 0 0 38 42 1 0 0 0 0 40 43 1 0 0 0 0 35 44 1 0 0 0 0 36 45 1 0 0 0 0 45 34 1 0 0 0 0 2 46 1 0 0 0 0 14 47 1 0 0 0 0 S SKP 5 ID FL2FEAGI0001 FORMULA C32H40O15 EXACTMASS 664.23672061 AVERAGEMASS 664.651 SMILES C(O)(C1Oc(c34)c(c(O)c(c(OC(c(c5)ccc(c5)O)CC4=O)3)CC=C(C)C)O)C(O)C(C(COC(C2O)OC(C(C(O)2)O)C)O1)O M END