Mol:FL7AAGGL0064
From Metabolomics.JP
(Difference between revisions)
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− | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
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− | 71 66 1 0 0 0 0 | + | 71 66 1 0 0 0 0 |
− | 71 72 1 0 0 0 0 | + | 71 72 1 0 0 0 0 |
− | 66 73 1 0 0 0 0 | + | 66 73 1 0 0 0 0 |
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− | 76 72 1 0 0 0 0 | + | 76 72 1 0 0 0 0 |
− | 69 22 1 0 0 0 0 | + | 69 22 1 0 0 0 0 |
− | M CHG 1 10 1 | + | M CHG 1 10 1 |
− | S SKP 5 | + | S SKP 5 |
− | ID FL7AAGGL0064 | + | ID FL7AAGGL0064 |
− | FORMULA C48H57O28 | + | FORMULA C48H57O28 |
− | EXACTMASS 1081.30363624 | + | EXACTMASS 1081.30363624 |
− | AVERAGEMASS 1081.94938 | + | AVERAGEMASS 1081.94938 |
− | SMILES C(O)(C8O)C(OC(C(O)8)C)OCC(C(O)7)OC(C(C7O)O)Oc(c(c(c5)cc(O)c(c5OC(O6)C(O)C(O)C(C6CO)O)O)4)cc(c([o+1]4)1)c(cc(OC(C(O)2)OC(COC(=O)C=Cc(c3)ccc(O)c3)C(O)C2O)c1)O | + | SMILES C(O)(C8O)C(OC(C(O)8)C)OCC(C(O)7)OC(C(C7O)O)Oc(c(c(c5)cc(O)c(c5OC(O6)C(O)C(O)C(C6CO)O)O)4)cc(c([o+1]4)1)c(cc(OC(C(O)2)OC(COC(=O)C=Cc(c3)ccc(O)c3)C(O)C2O)c1)O |
M END | M END | ||
− |
Latest revision as of 09:00, 14 March 2009
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72 1 0 0 0 0 69 22 1 0 0 0 0 M CHG 1 10 1 S SKP 5 ID FL7AAGGL0064 FORMULA C48H57O28 EXACTMASS 1081.30363624 AVERAGEMASS 1081.94938 SMILES C(O)(C8O)C(OC(C(O)8)C)OCC(C(O)7)OC(C(C7O)O)Oc(c(c(c5)cc(O)c(c5OC(O6)C(O)C(O)C(C6CO)O)O)4)cc(c([o+1]4)1)c(cc(OC(C(O)2)OC(COC(=O)C=Cc(c3)ccc(O)c3)C(O)C2O)c1)O M END