131835673
  CDK     0908232200

 27 30  0  0  0  0  0  0  0  0999 V2000
    4.2364    0.1136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6654    0.1136    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364   -2.3614    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6654   -1.5364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075   -1.5364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0929   -0.2989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1702    2.4275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075    0.9386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1173    2.6171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5777    2.6085    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2364   -1.5364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9508   -1.1239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -1.1239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9508   -0.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5219   -0.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8075    0.1136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6654    0.9386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9508    1.3511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3798    1.3511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9508    2.1761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3798    2.1761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6654    2.5886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1702    1.0996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1173    0.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6887    1.7636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8648    1.3339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8648    2.1933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 14  1  0  0  0  0 
  1 15  1  0  0  0  0 
  2 14  1  0  0  0  0 
  2 17  1  0  0  0  0 
  3 11  1  0  0  0  0 
  4 12  1  0  0  0  0 
  5 13  1  0  0  0  0 
  6 16  1  0  0  0  0 
  7 20  1  0  0  0  0 
  7 25  1  0  0  0  0 
  8 16  2  0  0  0  0 
  9 21  1  0  0  0  0 
  9 27  1  0  0  0  0 
 10 27  2  0  0  0  0 
 11 12  1  0  0  0  0 
 11 13  1  0  0  0  0 
 12 14  1  0  0  0  0 
 13 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 17 18  1  0  0  0  0 
 17 19  2  0  0  0  0 
 18 20  2  0  0  0  0 
 18 23  1  0  0  0  0 
 19 21  1  0  0  0  0 
 19 24  1  0  0  0  0 
 20 22  1  0  0  0  0 
 21 22  2  0  0  0  0 
 23 25  2  0  0  0  0 
 24 26  2  0  0  0  0 
 26 27  1  0  0  0  0 
M  END
> <ID>
CHEBI:197036

> <NAME>
3,4,5-trihydroxy-6-({7-oxo-7H-furo[3,2-g]chromen-4-yl}oxy)oxane-2-carboxylic acid

> <STAR>
2

> <IUPAC_NAME>
3,4,5-trihydroxy-6-(7-oxouro[3,2-g]chromen-4-yl)oxyoxane-2-carboxylic acid

> <FORMULA>
C17H14O10

> <MASS>
378.289

> <MONOISOTOPIC_MASS>
378.05870

> <CHARGE>
0

> <SMILES>
O1C(OC=2C3=C(OC=C3)C=C4OC(=O)C=CC24)C(O)C(O)C(O)C1C(O)=O

> <INCHI>
InChI=1S/C17H14O10/c18-10-2-1-6-9(25-10)5-8-7(3-4-24-8)14(6)26-17-13(21)11(19)12(20)15(27-17)16(22)23/h1-5,11-13,15,17,19-21H,(H,22,23)

> <INCHIKEY>
VLWJVRACXDFSKC-UHFFFAOYSA-N

$$$$