Mol:BMCCNP--q003

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Copyright: ARM project http://www.metabolome.jp/
 15 16  0  0  0  0  0  0  0  0999 V2000
    4.5981    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7321    2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981    2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  7  8  2  0  0  0  0
  7  6  1  0  0  0  0
  6  5  2  0  0  0  0
  5 10  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 10  4  2  0  0  0  0
  4  3  1  0  0  0  0
  3  2  2  0  0  0  0
  2  1  1  0  0  0  0
  1  9  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
  2 11  1  0  0  0  0
  1 14  1  0  0  0  0
  4 15  1  0  0  0  0
S  SKP  7
ID	BMCCNP--q003
NAME	1,4-Dihydroxy-2-naphthoic acid
FORMULA	C11H8O4
EXACTMASS	204.0422
AVERAGEMASS	204.1788
SMILES	OC(=O)c(c1)c(O)c(c2)c(ccc2)c(O)1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C03657
M  END

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