Mol:BMACIDCAm002

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BMACIDCAm002.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 19 19  0  0  1  0  0  0  0  0999 V2000 
    7.7365   -2.5229    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    6.9275   -3.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    6.1185   -2.5229    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    6.4275   -1.5719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.4275   -1.5719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.8397   -0.7629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.8452   -0.8674    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0 
    4.9497   -1.8619    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8506   -0.9719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.7406    0.1271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.8271    0.5339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.7226    1.5284    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0 
    2.8090    1.9351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.5316    2.1162    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0 
    4.4271    3.1107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.2629   -0.1629    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.4439   -1.8855    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0000    1.3474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.7045    2.9297    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  7  8  1  0  0  0  0 
  7  9  1  6  0  0  0 
  9 16  2  0  0  0  0 
  7  6  1  0  0  0  0 
  4  3  1  0  0  0  0 
  4  5  2  0  0  0  0 
  3  2  1  0  0  0  0 
  5  1  1  0  0  0  0 
  2  1  2  0  0  0  0 
  6  4  1  0  0  0  0 
  9 17  1  0  0  0  0 
  7 10  1  1  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 13 18  1  0  0  0  0 
 13 19  2  0  0  0  0 
 12 13  1  0  0  0  0 
 12 14  1  4  0  0  0 
 14 15  1  0  0  0  0 
S  SKP  7 
ID	BMACIDCAm002 
NAME	[4- [5- [(2S) -2-Amino-3-hydroxy-3-oxopropyl] -1H-imidazol-2-yl] -1-hydroxy-1-oxobutan-2-yl] -methylazanium 
CAS_RN	1029118-64-6 
FORMULA	C11H19N4O4 
EXACTMASS	271.1406 
AVERAGEMASS	271.2931 
SMILES	C[NH2+1]C(CC[C@](N)(C(O)=O)Cc(c1)ncn1)C(O)=O 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C04692 
M  END
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