Mol:BMMCIZ--e016

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Copyright: ARM project http://www.metabolome.jp/
 15 15  0  0  1  0  0  0  0  0999 V2000
    3.8968   -0.9531    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.4901   -0.0396    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.0779    0.7694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3090   -1.7622    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -2.7132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8090   -3.3010    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6180   -2.7132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3090   -1.7622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8913   -1.0577    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4955    0.0649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6711    1.6830    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2589    2.4920    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.0679    1.9042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4499    3.0798    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8467    3.3010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  4  1  0  0  0  0
  8  1  1  0  0  0  0
  1  9  1  6  0  0  0
  1  2  1  0  0  0  0
  2 10  1  1  0  0  0
  2  3  1  0  0  0  0
  3 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
S  SKP  7
ID	BMMCIZ--e016
NAME	D-erythro-Imidazole-glycerol phosphate
FORMULA	C6H11N2O6P
EXACTMASS	238.0354
AVERAGEMASS	238.1351
SMILES	O[C@@H](COP(O)(O)=O)[C@H](O)c(c1)ncn1
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04666
M  END

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