Mol:FL7AACGL0025

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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  37  38
M  SBL   1  1  40
M  SMT   1 CH2OH
M  SBV   1 40   -6.9314    5.1979
S  SKP  8
ID	FL7AACGL0025
KNApSAcK_ID	C00006795
NAME	Cyanidin 3-(3''-malonylglucoside)
CAS_RN	180129-51-5
FORMULA	C24H23O14
EXACTMASS	535.108780444
AVERAGEMASS	535.43102
SMILES	C(O)C(C1O)OC(Oc(c4)c([o+1]c(c43)cc(cc3O)O)c(c2)cc(c(c2)O)O)C(O)C(OC(CC(O)=O)=O)1
M  END

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