Mol:FL3F1AGS0001

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Copyright: ARM project http://www.metabolome.jp/
 30 33  0  0  0  0  0  0  0  0999 V2000
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    1.7326    0.0806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1763    0.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1763   -1.3837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9895    1.3836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2588    0.7319    0.0000 O   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
  1 18  1  0  0  0  0
 19 20  1  1  0  0  0
 20 21  1  1  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 19  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22 18  1  0  0  0  0
 15 28  1  0  0  0  0
 24 29  1  0  0  0  0
 29 30  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  29  30
M  SBL   1  1  32
M  SMT   1 ^CH2OH
M  SBV   1 32   -8.2848    5.0855
S  SKP  8
ID	FL3F1AGS0001
KNApSAcK_ID	C00004116
NAME	7,4'-Dihydroxyflavone 7-glucoside
CAS_RN	20633-86-7
FORMULA	C21H20O9
EXACTMASS	416.11073223799997
AVERAGEMASS	416.37809999999996
SMILES	Oc(c1)ccc(C(=C4)Oc(c3C(=O)4)cc(cc3)OC(O2)C(O)C(O)C(O)C2CO)c1
M  END

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