Mol:FL5FA9NI0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 27  0  0  0  0  0  0  0  0999 V2000 
    2.4587   -0.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4587    0.6666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8726    1.0050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2866    0.6666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.2866   -0.0101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8726   -0.3484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6448   -0.3806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0140   -0.0164    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6169   -0.3806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6169   -1.1090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0140   -1.4732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6448   -1.1090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.0140   -1.9574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0370   -1.5013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2477   -0.0164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8785   -0.3806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8785   -1.1090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2477   -1.4732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2477   -2.0072    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4587   -0.0457    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.2477    0.6665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6374    1.0188    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.6374    1.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0585    2.0072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1133    1.9478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  1  1  0  0  0  0 
  5  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12  7  2  0  0  0  0 
 11 13  2  0  0  0  0 
 12 14  1  0  0  0  0 
  9 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 17  1  0  0  0  0 
 17 18  2  0  0  0  0 
 18 10  1  0  0  0  0 
 18 19  1  0  0  0  0 
 16 20  1  0  0  0  0 
 15 21  1  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  2  0  0  0  0 
 23 24  1  0  0  0  0 
 23 25  1  0  0  0  0 
S  SKP  8 
ID	FL5FA9NI0001 
KNApSAcK_ID	C00001045 
NAME	Glepidotin A 
CAS_RN	42193-83-9 
FORMULA	C20H18O5 
EXACTMASS	338.115423686 
AVERAGEMASS	338.35392 
SMILES	c(c3O)(c2c(CC=C(C)C)c(O)c3)C(C(=C(O2)c(c1)cccc1)O)=O 
M  END