Mol:FL7AACGL0001

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Copyright: ARM project http://www.metabolome.jp/
 32 35  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
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  9 11  1  0  0  0  0
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  8 17  1  0  0  0  0
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 20 21  1  1  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 18  1  0  0  0  0
 19 17  1  0  0  0  0
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 22 26  1  0  0  0  0
  1 27  1  0  0  0  0
  3 28  1  0  0  0  0
 14 29  1  0  0  0  0
 13 30  1  0  0  0  0
 21 31  1  0  0  0  0
 31 32  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  31  32
M  SBL   1  1  34
M  SMT   1 CH2OH
M  SBV   1 34   -4.0142    2.6430
S  SKP  8
ID	FL7AACGL0001
KNApSAcK_ID	C00002374
NAME	Cyanidin 3-O-glucoside;Chrysanthemin
CAS_RN	7084-24-4
FORMULA	C21H21O11
EXACTMASS	449.108386514
AVERAGEMASS	449.38484
SMILES	C(C1Oc(c(c(c4)cc(c(O)c4)O)3)cc(c2[o+1]3)c(cc(O)c2)O)(O)C(O)C(O)C(O1)CO
M  END

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