Mol:FLID1CGS0004

<pre>

Copyright: ARM project http://www.metabolome.jp/
 35 40  0  0  0  0  0  0  0  0999 V2000
   -1.3550    0.3263    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7987    0.0051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2424    0.3263    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3137    0.0052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3137   -0.6607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8905   -0.9937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4672   -0.6607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4672    0.0052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8905    0.3382    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7985   -0.6369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2424   -0.9580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8943   -1.6301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0435   -0.9935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0435   -1.6301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5949   -1.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1462   -1.6301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1462   -0.9935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5949   -0.6752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4589    0.1225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1126   -0.3345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6141   -0.1406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0944   -0.1464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4826    0.2142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9919    0.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0907   -0.0468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6524   -0.3608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3284   -0.6202    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5292    0.9251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7517   -1.8269    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1259   -1.3118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7517   -0.7967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5292    1.6039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1259    1.9484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9326    1.9484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9919    0.6801    0.0000 C   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  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  4  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
  6 12  1  0  0  0  0
  7 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 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
 19 20  1  1  0  0  0
 20 21  1  1  0  0  0
 22 21  1  1  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 19  1  0  0  0  0
 19 25  1  0  0  0  0
 20 26  1  0  0  0  0
 21 27  1  0  0  0  0
 22  1  1  0  0  0  0
 14 12  1  0  0  0  0
 16 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 17  1  0  0  0  0
 28 32  1  0  0  0  0
 32 33  2  0  0  0  0
 32 34  1  0  0  0  0
 24 35  1  0  0  0  0
 35 28  1  0  0  0  0
S  SKP  8
ID	FLID1CGS0004
KNApSAcK_ID	C00010188
NAME	Trifolirhizin 6'-monoacetate;6'-O-Acetyltrifolirhizin
CAS_RN	60679-70-1
FORMULA	C24H24O11
EXACTMASS	488.13186161
AVERAGEMASS	488.44076
SMILES	c(c65)(OCO6)cc(C41)c(c5)OC1c(c3OC4)ccc(c3)OC(O2)C(O)C(C(O)C2COC(C)=O)O
M  END

</pre>