Mol:FL3FF9NS0006

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Copyright: ARM project http://www.metabolome.jp/
 22 25  0  0  0  0  0  0  0  0999 V2000
   -1.7189    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7189   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1626   -0.8468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6063    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1626    0.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500   -0.8468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5063   -0.5256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5063    0.1167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.4379    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500   -1.3476    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0624    0.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6293    0.1105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1963    0.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1963    1.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6293    1.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0624    1.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2962    1.0662    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9350    1.1334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1963    0.5466    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5991   -1.0073    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8846   -1.4198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  6 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20  1  1  0  0  0  0
  3 21  1  0  0  0  0
 21 22  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  21  22
M  SBL   1  1  24
M  SMT   1 OCH3
M  SBV   1 24   -6.7712    2.8850
S  SKP  8
ID	FL3FF9NS0006
KNApSAcK_ID	C00003996
NAME	5-Methoxy-7,8-methylenedioxyflavone
CAS_RN	70185-56-7
FORMULA	C17H12O5
EXACTMASS	296.068473494
AVERAGEMASS	296.27418
SMILES	COc(c1)c(C(=O)4)c(OC(=C4)c(c3)cccc3)c(O2)c(OC2)1
M  END

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