Mol:FL3FAADS0037

<pre>

Copyright: ARM project http://www.metabolome.jp/
 51 56  0  0  0  0  0  0  0  0999 V2000
    0.7034    0.5320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0110    0.9445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7255    0.5320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7255   -0.2930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0110   -0.7055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7034   -0.2930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400    0.9445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1544    0.5320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1544   -0.2930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400   -0.7055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8255    0.9194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4400   -1.4449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0110   -1.2775    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9203   -0.4361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3368   -1.0196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6197   -0.6110    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7946   -0.6248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3781   -0.0412    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0951   -0.4498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4635   -0.1721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1900   -0.1721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4312   -0.7310    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9617   -1.0196    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0610   -1.0384    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4851    0.9833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1996    0.5708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9140    0.9833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9140    1.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1996    2.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4851    1.8083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5292    2.1635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1148   -1.7099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5315   -2.2932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8147   -1.8847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9898   -1.8985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5731   -1.3150    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2899   -1.7234    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1148   -1.1380    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3201   -2.2932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2792   -2.1939    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6603    2.0942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1325    1.6514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8198    1.6027    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3815    1.1968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9093    1.6396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2219    1.6883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1135    2.2932    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7481    1.9338    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3201    1.4024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9547    0.4539    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4899   -0.7436    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  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  1  0  0  0  0
  6  1  2  0  0  0  0
  3  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  8 11  1  0  0  0  0
 10 12  1  0  0  0  0
  5 13  2  0  0  0  0
 14 15  1  1  0  0  0
 15 16  1  1  0  0  0
 17 16  1  1  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 14  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 14 22  1  0  0  0  0
 15 23  1  0  0  0  0
 16 24  1  0  0  0  0
  9 17  1  0  0  0  0
  1 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 30 25  1  0  0  0  0
 28 31  1  0  0  0  0
 32 33  1  1  0  0  0
 33 34  1  1  0  0  0
 35 34  1  1  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 37 32  1  0  0  0  0
 32 38  1  0  0  0  0
 33 39  1  0  0  0  0
 34 40  1  0  0  0  0
 35 24  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  1  0  0  0
 43 44  1  1  0  0  0
 45 44  1  1  0  0  0
 45 46  1  0  0  0  0
 46 41  1  0  0  0  0
 41 47  1  0  0  0  0
 46 48  1  0  0  0  0
 45 49  1  0  0  0  0
 31 42  1  0  0  0  0
 50 51  1  0  0  0  0
 44 50  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  50  51
M  SBL   1  1  56
M  SMT   1  CH2OH
M  SBV   1  56   -0.5733    0.7429
S  SKP  5
ID	FL3FAADS0037
FORMULA	C32H38O19
EXACTMASS	726.200729034
AVERAGEMASS	726.6327200000001
SMILES	C(C(C(O)1)OC(Oc(c6)ccc(c6)C(O2)=CC(=O)c(c(O)3)c(cc(O)c3C(C(OC(C(O)5)OCC(C5O)O)4)OC(C(C4O)O)CO)2)C(O)C1O)O
M  END

</pre>