Mol:FL1BAGNS0001

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Copyright: ARM project http://www.metabolome.jp/
 23 25  0  0  0  0  0  0  0  0999 V2000
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    1.4296    0.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1446    0.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1444    1.6495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4297    2.0617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7156    1.6490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7157    0.8240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3794   -1.2089    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  5  2  0  0  0  0
  6  4  2  0  0  0  0
  4  1  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  5  9  1  0  0  0  0
  9 10  2  0  0  0  0
  8 11  1  0  0  0  0
 11 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
 14 19  1  0  0  0  0
  3 20  1  0  0  0  0
 15 21  1  0  0  0  0
 16 22  1  0  0  0  0
  8 23  1  0  0  0  0
S  SKP  8
ID	FL1BAGNS0001
KNApSAcK_ID	C00014659
NAME	Amaronol A;(+)- 2,4,6-Trihydroxy-2-[(3,4,5-trihydroxyphenyl)methyl]-3(2H)-benzofuranone
CAS_RN	226560-96-9
FORMULA	C15H12O8
EXACTMASS	320.05321735999996
AVERAGEMASS	320.25098
SMILES	Oc(c3)cc(O1)c(c(O)3)C(=O)C(O)(Cc(c2)cc(O)c(O)c(O)2)1
M  END

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