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Mol:FL7AACGL0076 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 3 80 82 81<br />
M SBL 1 1 87<br />
M SMT 1 COOH<br />
M SVB 1 87 -4.1026 2.7589<br />
S SKP 8<br />
ID FL7AACGL0076<br />
KNApSAcK_ID C00006852<br />
NAME Cyanidin 3-(6'',6'''-di-p-coumarylsophoroside)-5-(6-malonylglucoside)<br />
CAS_RN 176260-03-0<br />
FORMULA C54H55O28<br />
EXACTMASS 1151.287986176<br />
AVERAGEMASS 1151.9977<br />
SMILES [C@@H]([C@H]8O)([C@@H](OC(COC(=O)CC(O)=O)[C@H](O)8)Oc(c1)c(c3)c([o+1]c(c(O[C@@H](C(O[C@@H](O6)[C@H](O)[C@@H]([C@@H](C(COC(=O)C=Cc(c7)ccc(c7)O)6)O)O)5)O[C@@H]([C@H](O)C5O)COC(=O)C=Cc(c4)ccc(O)c4)3)c(c2)cc(c(c2)O)O)cc1O)O<br />
M END<br />
</pre></div>
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