Mol:FL2F1ANI0012

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 25 27  0  0  0  0  0  0  0  0999 V2000 
   -2.1918   -0.4158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1895   -1.2383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4725   -1.6501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7609   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.7610   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4764   -0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0428   -1.6499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6680   -1.2373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.6662   -0.4092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0466    0.0001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3806    0.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0934   -0.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8078    0.0065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.8077    0.8316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.0932    1.2439    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.3787    0.8313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -0.0428   -2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9062   -0.0033    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1912    2.0624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1912    1.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4764    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.9058    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.4768    2.4748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    3.5097    1.2369    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.5097   -0.3518    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 
  4  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  5  1  0  0  0  0 
  9 11  1  6  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
  7 17  2  0  0  0  0 
  1 18  1  0  0  0  0 
  6 21  1  0  0  0  0 
 19 20  2  0  0  0  0 
 20 21  1  0  0  0  0 
 19 22  1  0  0  0  0 
 19 23  1  0  0  0  0 
 14 24  1  0  0  0  0 
 18 25  1  0  0  0  0 
S  SKP  8 
ID	FL2F1ANI0012 
KNApSAcK_ID	C00014155 
NAME	4'-Hydroxyisoderricin;Mundulea flavanone A;4'-Hydroxy-7-methoxy-8-prenylflavanone 
CAS_RN	126909-50-0 
FORMULA	C21H22O4 
EXACTMASS	338.151809192 
AVERAGEMASS	338.39698 
SMILES	Oc(c1)ccc(C(C2)Oc(c(CC=C(C)C)3)c(ccc3OC)C(=O)2)c1 
M  END