Mol:FL4DAAGI0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 37 40  0  0  0  0  0  0  0  0999 V2000
   -0.9978   -0.8295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2777   -0.4233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0066   -1.6525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2938   -2.0733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4218   -1.6705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4331   -0.8456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1349   -2.0928    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8530   -1.6861    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8598   -0.8613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1531   -0.4429    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981   -0.4453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6070    0.3802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3262    0.7857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0345    0.3668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0281   -0.4562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3082   -0.8642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1200   -2.9177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7061   -0.4104    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5414   -2.0836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2938   -2.8244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3262    1.5333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7679    0.7902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7373    1.8733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7373    2.5722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3357    2.9177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1619    2.9044    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2847   -0.3046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8721   -1.0193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0737   -0.8101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2803   -1.0370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6928   -0.3222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4912   -0.5313    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6482    0.0545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1281    0.3316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7679   -0.7878    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3208   -0.7602    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2452   -1.4501    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  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  2  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  1  0  0  0  0
 10  6  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
  8 19  1  1  0  0  0
  4 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
 21 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 27 28  1  1  0  0  0
 28 29  1  1  0  0  0
 30 29  1  1  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 27  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 27 35  1  0  0  0  0
 28 36  1  0  0  0  0
 29 37  1  0  0  0  0
 30 18  1  0  0  0  0
S  SKP  8
ID	FL4DAAGI0004
KNApSAcK_ID	C00014416
NAME	Phellochinin A;3,5,7,4'-Tetrahydroxy-3'-prenylflavanone 7-glucoside
CAS_RN	220860-05-9
FORMULA	C26H30O11
EXACTMASS	518.1788118019999
AVERAGEMASS	518.5098
SMILES	C(C(O1)C(O)C(C(O)C1Oc(c2)cc(O)c(C3=O)c2OC(c(c4)cc(c(O)c4)CC=C(C)C)C3O)O)O
M  END

</pre>