Mol:FL5FELNS0002

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FL5FELNS0002.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
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    0.2622   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2941    0.1452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2941   -1.6403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8183    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853   -0.1822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9523    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9523    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853    1.1271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8183    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8183   -1.1394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5191    0.1451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5191   -1.1394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4067   -1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853    1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5191    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2515    1.1270    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 
  8 18  1  0  0  0  0 
  1 19  1  0  0  0  0 
  2 20  1  0  0  0  0 
  3 21  1  0  0  0  0 
 16 22  1  0  0  0  0 
 15 23  1  0  0  0  0 
 17 24  1  0  0  0  0 
S  SKP  8 
ID	FL5FELNS0002 
KNApSAcK_ID	C00004805 
NAME	3,5,6,7,2',3',4'-Heptahydroxyflavone 
CAS_RN	72947-67-2 
FORMULA	C15H10O9 
EXACTMASS	334.03248191800003 
AVERAGEMASS	334.2345 
SMILES	Oc(c3)c(O)c(O)c(c3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O)c(O)2)1 
M  END
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