Mol:FL5FPTNS0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 23 26  0  0  0  0  0  0  0  0999 V2000 
   -1.9630   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.9630   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4067   -1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8504   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.8504   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4067    0.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2941   -1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2622   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2622   -0.1760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2941    0.1452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.2941   -1.6403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8183    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853   -0.1822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9523    0.1451    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.9523    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853    1.1271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8183    0.7998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5191    1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4067   -1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.5191    0.1451    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    0.8231   -1.1422    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853   -0.8183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3853    1.7816    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  2  3  2  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  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  2  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  7 11  2  0  0  0  0 
  9 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
 15 18  1  0  0  0  0 
  3 19  1  0  0  0  0 
  1 20  1  0  0  0  0 
  8 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 13  1  0  0  0  0 
 16 23  1  0  0  0  0 
S  SKP  8 
ID	FL5FPTNS0001 
KNApSAcK_ID	C00005107 
NAME	2,3,8,10-Tetrahydroxy[2]benzopyrano[4,3-b][1]benzopyran-7(5H)-one 
CAS_RN	77394-26-4 
FORMULA	C16H10O7 
EXACTMASS	314.042652674 
AVERAGEMASS	314.2464 
SMILES	Oc(c4)cc(O1)c(c(O)4)C(=O)C(O3)=C1c(c2)c(C3)cc(O)c(O)2 
M  END