Mol:FL3FAAGS0014

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 34  0  0  0  0  0  0  0  0999 V2000 
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   -3.8282   -0.8445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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   -1.6030   -0.2021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.0499    1.4891    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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    2.4077    1.0308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.3299    1.2962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.1068    1.8078    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    4.1048    1.1662    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    3.6699    0.8444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  3  4  1  0  0  0  0 
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  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
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  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
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  9 12  1  0  0  0  0 
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 24 30  1  0  0  0  0 
 30 31  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  30  31 
M  SBL   1  1  33 
M  SMT   1 CH2OH 
M  SBV   1 33   -6.2200    3.6608 
S  SKP  8 
ID	FL3FAAGS0014 
KNApSAcK_ID	C00004149 
NAME	Apigenin 4'-glucoside 
CAS_RN	20486-34-4 
FORMULA	C21H20O10 
EXACTMASS	432.10564686 
AVERAGEMASS	432.37749999999994 
SMILES	c(c1C(=C3)Oc(c4)c(c(cc(O)4)O)C(=O)3)cc(OC(O2)C(O)C(O)C(O)C2CO)cc1 
M  END