Mol:FL5F1GNS0003

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Copyright: ARM project http://www.metabolome.jp/
 24 26  0  0  0  0  0  0  0  0999 V2000
   -1.4277   -1.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4277   -0.2984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1421    0.1141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8566   -0.2984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8566   -1.1234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1421   -1.5359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7132   -1.5359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0013   -1.1233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0012   -0.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7132    0.1141    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7157    0.1143    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4301   -0.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1445    0.1144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1445    0.9394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4301    1.3519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7156    0.9394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7132   -2.3609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5711    0.1141    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7158   -1.5358    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8590    1.3519    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4301    2.0247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8478    2.3609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8578   -0.2974    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5711    0.1145    0.0000 C   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  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
  1  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  2  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 11  1  0  0  0  0
  7 17  2  0  0  0  0
  4 18  1  0  0  0  0
  8 19  1  0  0  0  0
 14 20  1  0  0  0  0
 15 21  1  0  0  0  0
 21 22  1  0  0  0  0
 13 23  1  0  0  0  0
 23 24  1  0  0  0  0
S  SKP  8
ID	FL5F1GNS0003
KNApSAcK_ID	C00013361
NAME	Laurentinol;3,7-Dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN	244248-20-2
FORMULA	C17H14O7
EXACTMASS	330.073952802
AVERAGEMASS	330.28886
SMILES	COc(c1)c(O)c(OC)cc1C(O2)=C(O)C(=O)c(c3)c(cc(O)c3)2
M  END

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