ID C0071  
Compound name Cyanidin 3-O-[2''-O-(6'''-O-(sinapoyl) xylosyl) 6''-O-(p-O-(glucosyl)-p-coumaroyl) glucoside] 5-O-(6''''-O-malonyl) glucoside
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Mass information 1st experiment  :  LC-Q-TOF/MS (Positive ion mode)
2nd experiment  :  
Molecular Formula C61H67O34
Canonical SMILES OC2C(O)C(O)C(OC2CO)Oc(cc9)ccc9C=CC(=O)OCC(C4O)OC(C(C4O)OC(C3O)COC(O)C3OC(=O)C=Cc(cc(OC)c5O)cc5OC)Oc8cc6c(OC(C(O)C(O)C1O)OC1COC(=O)CC(O)=O)cc(O)cc6[o+]c8-c(cc7O)ccc7O
Molecular Weight 1344.16
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