Mol:FL7AACGL0044

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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  48  49
M  SBL   1  1  52
M  SMT   1 ^CH2OH
M  SBV   1 52   -6.3245    5.5759
S  SKP  8
ID	FL7AACGL0044
KNApSAcK_ID	C00006815
NAME	Cyanidin 3-(6''-malonylglucoside)-5-glucoside
CAS_RN	104055-86-9
FORMULA	C30H33O19
EXACTMASS	697.161603874
AVERAGEMASS	697.57162
SMILES	c(c(O)5)(cc(cc5)c(c(OC(O4)C(C(C(C4COC(CC(O)=O)=O)O)O)O)1)[o+1]c(c3)c(c(cc3O)OC(O2)C(C(O)C(O)C2CO)O)c1)O
M  END

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