Mol:BMMCTZ--e008

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BMMCTZ--e008.png

 
 
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 13 13  0  0  0  0  0  0  0  0999 V2000 
    4.2756   -1.4099    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5847   -2.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7756   -2.9488    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9666   -2.3610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2756   -1.4099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0156   -2.6700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.6879   -0.6009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0946    0.3126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5068    1.1217    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.9135    2.0352    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8271    1.6285    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    2.4419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.3203    2.9488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  5  4  2  0  0  0  0 
  3  2  2  0  0  0  0 
  2  1  1  0  0  0  0 
  1  5  1  0  0  0  0 
  4  3  1  0  0  0  0 
  4  6  1  0  0  0  0 
  5  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
 10 13  2  0  0  0  0 
S  SKP  7 
ID	BMMCTZ--e008 
NAME	2- (4-Methyl-1,3-thiazol-5-yl) ethyl dihydrogen phosphate 
CAS_RN	3269-79-2 
FORMULA	C6H10NO4PS 
EXACTMASS	223.0068 
AVERAGEMASS	223.1877 
SMILES	Cc(n1)c(CCOP(O)(O)=O)sc1 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04327 
M  END
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