Mol:FL5FACGS0075
From Metabolomics.JP
(Difference between revisions)
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− | 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 |
− | 3.3316 3.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3316 3.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3316 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3316 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.0461 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0461 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.7605 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7605 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.7605 3.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7605 3.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.0461 3.7937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0461 3.7937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6171 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6171 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9027 2.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9027 2.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1882 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1882 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1882 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1882 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9027 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9027 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.6171 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6171 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4738 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4738 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2406 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2406 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.2406 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2406 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4738 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4738 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.9027 0.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9027 0.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9551 2.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9551 2.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.3316 0.9063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3316 0.9063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4738 0.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4738 0.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.3523 3.7229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3523 3.7229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.3890 2.1934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.3890 2.1934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.0994 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0994 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8671 -1.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8671 -1.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.3620 -0.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3620 -0.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.1244 -0.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1244 -0.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.3567 0.1049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3567 0.1049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.8617 -0.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8617 -0.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.1611 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1611 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4444 -0.8109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4444 -0.8109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.7182 -1.3559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7182 -1.3559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.3368 -1.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3368 -1.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.2408 -0.6789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2408 -0.6789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.0461 -1.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0461 -1.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.3314 -2.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3314 -2.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.7447 -1.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7447 -1.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.0559 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0559 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.6588 -1.0826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6588 -1.0826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2457 -1.6629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2457 -1.6629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.8559 -1.4651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8559 -1.4651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.7593 -1.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7593 -1.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3853 -2.4024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3853 -2.4024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7849 -2.5675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7849 -2.5675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.1294 -2.0070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1294 -2.0070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.3572 -2.1582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3572 -2.1582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.9408 -2.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9408 -2.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.1156 -2.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1156 -2.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.3987 -3.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3987 -3.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.8150 -2.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.8150 -2.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.6402 -2.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6402 -2.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.5417 -3.7937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5417 -3.7937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.7871 -3.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7871 -3.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.3890 -2.4379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.3890 -2.4379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.9690 -2.0978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9690 -2.0978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
− | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
− | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
− | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
− | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
− | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
− | 2 7 1 0 0 0 0 | + | 2 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 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
− | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
− | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
− | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
− | 9 13 1 0 0 0 0 | + | 9 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 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
− | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
− | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
− | 12 19 1 0 0 0 0 | + | 12 19 1 0 0 0 0 |
− | 16 20 1 0 0 0 0 | + | 16 20 1 0 0 0 0 |
− | 5 21 1 0 0 0 0 | + | 5 21 1 0 0 0 0 |
− | 4 22 1 0 0 0 0 | + | 4 22 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 28 1 0 0 0 0 | + | 27 28 1 0 0 0 0 |
− | 28 23 1 0 0 0 0 | + | 28 23 1 0 0 0 0 |
− | 28 29 1 0 0 0 0 | + | 28 29 1 0 0 0 0 |
− | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
− | 23 31 1 0 0 0 0 | + | 23 31 1 0 0 0 0 |
− | 24 32 1 0 0 0 0 | + | 24 32 1 0 0 0 0 |
− | 25 33 1 0 0 0 0 | + | 25 33 1 0 0 0 0 |
− | 26 19 1 0 0 0 0 | + | 26 19 1 0 0 0 0 |
− | 34 35 1 1 0 0 0 | + | 34 35 1 1 0 0 0 |
− | 35 36 1 1 0 0 0 | + | 35 36 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 39 1 0 0 0 0 | + | 38 39 1 0 0 0 0 |
− | 39 34 1 0 0 0 0 | + | 39 34 1 0 0 0 0 |
− | 39 40 1 0 0 0 0 | + | 39 40 1 0 0 0 0 |
− | 40 41 1 0 0 0 0 | + | 40 41 1 0 0 0 0 |
− | 34 42 1 0 0 0 0 | + | 34 42 1 0 0 0 0 |
− | 35 43 1 0 0 0 0 | + | 35 43 1 0 0 0 0 |
− | 36 44 1 0 0 0 0 | + | 36 44 1 0 0 0 0 |
− | 37 30 1 0 0 0 0 | + | 37 30 1 0 0 0 0 |
− | 45 46 1 0 0 0 0 | + | 45 46 1 0 0 0 0 |
− | 46 47 1 1 0 0 0 | + | 46 47 1 1 0 0 0 |
− | 48 47 1 1 0 0 0 | + | 48 47 1 1 0 0 0 |
− | 49 48 1 1 0 0 0 | + | 49 48 1 1 0 0 0 |
− | 49 50 1 0 0 0 0 | + | 49 50 1 0 0 0 0 |
− | 50 45 1 0 0 0 0 | + | 50 45 1 0 0 0 0 |
− | 48 51 1 0 0 0 0 | + | 48 51 1 0 0 0 0 |
− | 47 52 1 0 0 0 0 | + | 47 52 1 0 0 0 0 |
− | 46 53 1 0 0 0 0 | + | 46 53 1 0 0 0 0 |
− | 45 54 1 0 0 0 0 | + | 45 54 1 0 0 0 0 |
− | 49 41 1 0 0 0 0 | + | 49 41 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID FL5FACGS0075 | + | ID FL5FACGS0075 |
− | FORMULA C33H40O21 | + | FORMULA C33H40O21 |
− | EXACTMASS 772.206208342 | + | EXACTMASS 772.206208342 |
− | AVERAGEMASS 772.6581 | + | AVERAGEMASS 772.6581 |
− | SMILES c(c21)(OC(c(c6)ccc(O)c6O)=C(OC(C3O)OC(COC(C(O)5)OC(C(O)C5O)COC(O4)C(O)C(C(O)C(C)4)O)C(C3O)O)C2=O)cc(cc1O)O | + | SMILES c(c21)(OC(c(c6)ccc(O)c6O)=C(OC(C3O)OC(COC(C(O)5)OC(C(O)C5O)COC(O4)C(O)C(C(O)C(C)4)O)C(C3O)O)C2=O)cc(cc1O)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 3.3316 3.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3316 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0461 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7605 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7605 3.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0461 3.7937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6171 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 2.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1882 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1882 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6171 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4738 2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2406 2.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2406 1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4738 0.9063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 0.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9551 2.5563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3316 0.9063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4738 0.0814 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3523 3.7229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 2.1934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0994 -0.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8671 -1.1745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -0.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1244 -0.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3567 0.1049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8617 -0.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1611 -0.3994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4444 -0.8109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7182 -1.3559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3368 -1.5339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2408 -0.6789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0461 -1.8633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3314 -2.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7447 -1.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0559 -1.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6588 -1.0826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2457 -1.6629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8559 -1.4651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7593 -1.8583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3853 -2.4024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7849 -2.5675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1294 -2.0070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3572 -2.1582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9408 -2.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1156 -2.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3987 -3.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -2.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6402 -2.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5417 -3.7937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7871 -3.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 -2.4379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -2.0978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 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 28 1 0 0 0 0 28 23 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 25 33 1 0 0 0 0 26 19 1 0 0 0 0 34 35 1 1 0 0 0 35 36 1 1 0 0 0 37 36 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 34 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 34 42 1 0 0 0 0 35 43 1 0 0 0 0 36 44 1 0 0 0 0 37 30 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 1 0 0 0 48 47 1 1 0 0 0 49 48 1 1 0 0 0 49 50 1 0 0 0 0 50 45 1 0 0 0 0 48 51 1 0 0 0 0 47 52 1 0 0 0 0 46 53 1 0 0 0 0 45 54 1 0 0 0 0 49 41 1 0 0 0 0 S SKP 5 ID FL5FACGS0075 FORMULA C33H40O21 EXACTMASS 772.206208342 AVERAGEMASS 772.6581 SMILES c(c21)(OC(c(c6)ccc(O)c6O)=C(OC(C3O)OC(COC(C(O)5)OC(C(O)C5O)COC(O4)C(O)C(C(O)C(C)4)O)C(C3O)O)C2=O)cc(cc1O)O M END