Mol:FL7AACGL0049

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Copyright: ARM project http://www.metabolome.jp/
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M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  53  54
M  SBL   1  1  58
M  SMT   1 CH2OH
M  SBV   1 58   -5.1377    3.4522
S  SKP  8
ID	FL7AACGL0049
KNApSAcK_ID	C00006820
NAME	Gentiocyanin C;Cyanidin 3-glucoside-5-(6-p-coumaroylglucoside)
CAS_RN	170900-28-4
FORMULA	C36H37O18
EXACTMASS	757.1979893800001
AVERAGEMASS	757.66818
SMILES	C(C(C6O)OC(C(C(O)6)O)Oc(c2)c(c4)c([o+1]c(c(OC(O5)C(C(O)C(C(CO)5)O)O)4)c(c3)ccc(O)c(O)3)cc2O)OC(C=Cc(c1)ccc(c1)O)=O
M  END

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