Mol:FL1CEANS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 25  0  0  0  0  0  0  0  0999 V2000 
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    1.0059   -0.2866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.5669   -0.6105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1279   -0.2866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.1279    0.3612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  1  2  1  0  0  0  0 
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  3  4  1  0  0  0  0 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  23  24 
M  SBL   3  1  24 
M  SMT   3  OCH3 
M  SVB   3 24   -1.4972    1.2499 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  21  22 
M  SBL   2  1  22 
M  SMT   2  OCH3 
M  SVB   2 22   -2.6887    0.9745 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  19  20 
M  SBL   1  1  20 
M  SMT   1  OCH3 
M  SVB   1 20   -0.6628    0.6768 
S  SKP  8 
ID	FL1CEANS0001 
KNApSAcK_ID	C00006979 
NAME	4,6'-Dihydroxy-2',3',4'-trimethoxychalcone 
CAS_RN	59567-92-9 
FORMULA	C18H18O6 
EXACTMASS	330.110338308 
AVERAGEMASS	330.33191999999997 
SMILES	c(c1C(=O)C=Cc(c2)ccc(O)c2)(O)cc(c(c1OC)OC)OC 
M  END