Mol:BMAAS4HOe005

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BMAAS4HOe005.png

 
 
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 13 12  0  0  1  0  0  0  0  0999 V2000 
    4.7321    2.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7321    1.2500    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0 
    3.8660    0.7500    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    3.8660   -0.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5981    0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    5.5981    2.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8660    2.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0000    1.2500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0000   -0.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0000   -1.7500    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.0000   -2.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.0000   -1.7500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
 10 11  2  0  0  0  0 
  4  9  1  0  0  0  0 
 10 12  1  0  0  0  0 
  3  8  1  4  0  0  0 
  9 10  1  0  0  0  0 
  2  5  1  1  0  0  0 
  3  4  1  0  0  0  0 
  2  1  1  0  0  0  0 
 10 13  1  0  0  0  0 
  1  7  2  0  0  0  0 
  2  3  1  0  0  0  0 
  1  6  1  0  0  0  0 
S  SKP  7 
ID	BMAAS4HOe005 
NAME	(2S,3S) -2-Amino-3-hydroxy-4-phosphonooxybutanoic acid 
CAS_RN	 94987-72-1 
FORMULA	C4H10NO7P 
EXACTMASS	215.0194 
AVERAGEMASS	215.0985 
SMILES	N[C@H](C(O)=O)C(O)COP(O)(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C06055 
M  END
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