Mol:FL3FAACS0039
From Metabolomics.JP
(Difference between revisions)
Line 1: | Line 1: | ||
− | + | ||
− | + | ||
− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
− | 51 55 0 0 0 0 0 0 0 0999 V2000 | + | 51 55 0 0 0 0 0 0 0 0999 V2000 |
− | -0.1291 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1291 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.1291 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1291 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5854 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5854 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.2998 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2998 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 1.2998 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2998 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5854 -0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5854 -0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0142 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0142 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.7286 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7286 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.7286 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7286 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0142 -0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0142 -0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 2.0142 -2.7165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0142 -2.7165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.4428 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4428 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.1710 -0.8439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1710 -0.8439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.8991 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8991 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.8991 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8991 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 4.1710 0.8377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.1710 0.8377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 3.4428 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4428 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 5.6271 0.8376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.6271 0.8376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.5854 -2.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5854 -2.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.8432 -0.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8432 -0.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0362 0.7270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0362 0.7270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6932 0.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6932 0.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.4617 1.1157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4617 1.1157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6932 1.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6932 1.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.0362 2.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0362 2.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.1951 1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1951 1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.1417 2.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1417 2.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.6945 2.6813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6945 2.6813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.5151 1.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5151 1.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | 0.9980 0.8061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9980 0.8061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.2023 1.5443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2023 1.5443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9536 1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9536 1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.7045 1.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7045 1.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.4554 1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4554 1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.2046 1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2046 1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.9524 1.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9524 1.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.9495 2.7171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9495 2.7171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.4540 2.7914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4540 2.7914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -3.4540 1.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4540 1.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -4.9524 2.7701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9524 2.7701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -5.6271 1.5877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.6271 1.5877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7358 -1.9737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7358 -1.9737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -0.9688 -2.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9688 -2.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4261 -1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4261 -1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.4826 -0.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4826 -0.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2497 -0.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2497 -0.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.7924 -1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7924 -1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.2180 -0.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2180 -0.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -1.6488 -0.2405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6488 -0.2405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.4786 -1.0217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4786 -1.0217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
− | -2.3607 -2.1498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3607 -2.1498 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 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 |
− | 15 18 1 0 0 0 0 | + | 15 18 1 0 0 0 0 |
− | 3 19 1 0 0 0 0 | + | 3 19 1 0 0 0 0 |
− | 1 20 1 0 0 0 0 | + | 1 20 1 0 0 0 0 |
− | 22 21 1 1 0 0 0 | + | 22 21 1 1 0 0 0 |
− | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
− | 23 24 1 0 0 0 0 | + | 23 24 1 0 0 0 0 |
− | 24 25 1 0 0 0 0 | + | 24 25 1 0 0 0 0 |
− | 25 26 1 1 0 0 0 | + | 25 26 1 1 0 0 0 |
− | 26 21 1 1 0 0 0 | + | 26 21 1 1 0 0 0 |
− | 25 27 1 0 0 0 0 | + | 25 27 1 0 0 0 0 |
− | 24 28 1 0 0 0 0 | + | 24 28 1 0 0 0 0 |
− | 26 29 1 0 0 0 0 | + | 26 29 1 0 0 0 0 |
− | 23 30 1 0 0 0 0 | + | 23 30 1 0 0 0 0 |
− | 22 6 1 0 0 0 0 | + | 22 6 1 0 0 0 0 |
− | 29 31 1 0 0 0 0 | + | 29 31 1 0 0 0 0 |
− | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
− | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
− | 33 34 1 0 0 0 0 | + | 33 34 1 0 0 0 0 |
− | 34 35 1 0 0 0 0 | + | 34 35 1 0 0 0 0 |
− | 35 36 1 0 0 0 0 | + | 35 36 1 0 0 0 0 |
− | 32 37 2 0 0 0 0 | + | 32 37 2 0 0 0 0 |
− | 34 38 1 0 0 0 0 | + | 34 38 1 0 0 0 0 |
− | 34 39 1 0 0 0 0 | + | 34 39 1 0 0 0 0 |
− | 36 40 2 0 0 0 0 | + | 36 40 2 0 0 0 0 |
− | 36 41 1 0 0 0 0 | + | 36 41 1 0 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 45 1 0 0 0 0 | + | 44 45 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 |
− | 47 42 1 1 0 0 0 | + | 47 42 1 1 0 0 0 |
− | 46 48 1 0 0 0 0 | + | 46 48 1 0 0 0 0 |
− | 45 49 1 0 0 0 0 | + | 45 49 1 0 0 0 0 |
− | 47 50 1 0 0 0 0 | + | 47 50 1 0 0 0 0 |
− | 42 51 1 0 0 0 0 | + | 42 51 1 0 0 0 0 |
− | 43 2 1 0 0 0 0 | + | 43 2 1 0 0 0 0 |
− | S SKP 5 | + | S SKP 5 |
− | ID FL3FAACS0039 | + | ID FL3FAACS0039 |
− | FORMULA C33H38O18 | + | FORMULA C33H38O18 |
− | EXACTMASS 722.205814412 | + | EXACTMASS 722.205814412 |
− | AVERAGEMASS 722.64402 | + | AVERAGEMASS 722.64402 |
− | SMILES Oc(c5)ccc(c5)C(=C4)Oc(c(C4=O)2)c(c(c(C(C(O)3)OC(C)C(O)C3O)c2O)O)C(C1O)OC(COC(CC(C)(O)CC(O)=O)=O)C(C1O)O | + | SMILES Oc(c5)ccc(c5)C(=C4)Oc(c(C4=O)2)c(c(c(C(C(O)3)OC(C)C(O)C3O)c2O)O)C(C1O)OC(COC(CC(C)(O)CC(O)=O)=O)C(C1O)O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/ 51 55 0 0 0 0 0 0 0 0999 V2000 -0.1291 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1291 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5854 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2998 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2998 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5854 -0.4233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0142 -2.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7286 -1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7286 -0.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0142 -0.4233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0142 -2.7165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4428 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -0.8439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8991 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8991 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 0.8377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4428 0.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6271 0.8376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5854 -2.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8432 -0.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0362 0.7270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6932 0.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4617 1.1157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6932 1.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0362 2.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1951 1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1417 2.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6945 2.6813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5151 1.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 0.8061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2023 1.5443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9536 1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7045 1.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4554 1.9780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2046 1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9524 1.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9495 2.7171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 2.7914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 1.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9524 2.7701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6271 1.5877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7358 -1.9737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9688 -2.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4261 -1.4784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4826 -0.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2497 -0.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7924 -1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -0.0324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6488 -0.2405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4786 -1.0217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3607 -2.1498 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 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 15 18 1 0 0 0 0 3 19 1 0 0 0 0 1 20 1 0 0 0 0 22 21 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 1 0 0 0 26 21 1 1 0 0 0 25 27 1 0 0 0 0 24 28 1 0 0 0 0 26 29 1 0 0 0 0 23 30 1 0 0 0 0 22 6 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 32 37 2 0 0 0 0 34 38 1 0 0 0 0 34 39 1 0 0 0 0 36 40 2 0 0 0 0 36 41 1 0 0 0 0 43 42 1 1 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 1 0 0 0 47 42 1 1 0 0 0 46 48 1 0 0 0 0 45 49 1 0 0 0 0 47 50 1 0 0 0 0 42 51 1 0 0 0 0 43 2 1 0 0 0 0 S SKP 5 ID FL3FAACS0039 FORMULA C33H38O18 EXACTMASS 722.205814412 AVERAGEMASS 722.64402 SMILES Oc(c5)ccc(c5)C(=C4)Oc(c(C4=O)2)c(c(c(C(C(O)3)OC(C)C(O)C3O)c2O)O)C(C1O)OC(COC(CC(C)(O)CC(O)=O)=O)C(C1O)O M END