3-formyl-6-methoxy-1H-indole-2-carboxylic Acid
  -molcms-05212615042D

 16 17  0  0  0  0  0  0  0  0999 V2000
   -2.5981    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4641    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7321    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7321    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9511   -0.3090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2601   -1.2601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5909   -2.0032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5388    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5388    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0388   -0.3660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0388    1.3660    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9511    1.3090    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  7 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
 10 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15  6  2  0  0  0  0
 15 16  1  0  0  0  0
 16  3  2  0  0  0  0
M  END
>  <ProductName>
3-formyl-6-methoxy-1H-indole-2-carboxylic Acid

>  <CASNumber>
858752-19-9

>  <MolecularFormula>
C11H9NO4

>  <MDLNo>
MFCD03848057

>  <MolWt>
219.19

>  <BoilingPoint>
505.6��50.0 ��C at 760 mmHg

>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
O(C)C1C=CC2C(C=O)=C(C(=O)O)NC=2C=1

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