Mol:FL5FABGI0008

<pre>

Copyright: ARM project http://www.metabolome.jp/
 49 53  0  0  0  0  0  0  0  0999 V2000
    0.1408   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1408   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6971   -1.2845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2534   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2534   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6971    0.0002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097   -1.2845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660   -0.9633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097    0.0002    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097   -1.7853    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9221    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4891   -0.3272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0561    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0561    0.6548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4891    0.9821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9221    0.6548    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4153    0.0001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7602   -1.3522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6971   -1.9266    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6971    0.6424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1410    0.9634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1410    1.6055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6971    1.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4151    1.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4723   -0.4064    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1011   -0.8964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5666   -0.6885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0508   -0.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4256   -0.3081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8932   -0.5549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9861   -0.7031    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6797   -0.9246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2603   -1.2026    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8235   -1.0871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4523   -1.5770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9178   -1.3692    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4021   -1.3636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7769   -0.9887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2445   -1.2355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3374   -1.3837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0310   -1.6052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6116   -1.8833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2917    0.2293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4948    0.0158    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6429   -0.4513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8460   -0.6649    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6229    0.9821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3374    0.5696    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  1  2  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  7 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  1 18  1  0  0  0  0
  8 19  1  0  0  0  0
  3 20  1  0  0  0  0
  6 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
 26 27  1  1  0  0  0
 27 28  1  1  0  0  0
 29 28  1  1  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 26  1  0  0  0  0
 26 32  1  0  0  0  0
 27 33  1  0  0  0  0
 28 34  1  0  0  0  0
 29 18  1  0  0  0  0
 35 36  1  1  0  0  0
 36 37  1  1  0  0  0
 38 37  1  1  0  0  0
 38 39  1  0  0  0  0
 39 40  1  0  0  0  0
 40 35  1  0  0  0  0
 35 41  1  0  0  0  0
 36 42  1  0  0  0  0
 37 43  1  0  0  0  0
 38 32  1  0  0  0  0
 31 44  1  0  0  0  0
 44 45  1  0  0  0  0
 40 46  1  0  0  0  0
 46 47  1  0  0  0  0
 15 48  1  0  0  0  0
 48 49  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  44  45
M  SBL   1  1  48
M  SMT   1 ^CH2OH
M  SBV   1 48   -7.4310    4.1345
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  46  47
M  SBL   2  1  50
M  SMT   2 ^CH2OH
M  SBV   2 50   -7.4310    4.1345
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  48  49
M  SBL   3  1  52
M  SMT   3 OCH3
M  SBV   3 52   -6.4657    3.6776
S  SKP  8
ID	FL5FABGI0008
KNApSAcK_ID	C00005825
NAME	Cuhuoside;8-Prenylkaempferol 4'-methyl ether 7-cellobioside;7-[(4-O-beta-D-Glucopyranosyl-beta-D-glucopyranosyl)oxy]-3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one
CAS_RN	150903-46-1
FORMULA	C33H40O16
EXACTMASS	692.2316352319999
AVERAGEMASS	692.6611
SMILES	c(OC)(c5)ccc(c5)C(=C(O)1)Oc(c2CC=C(C)C)c(c(O)cc2OC(C3O)OC(C(OC(O4)C(C(C(C4CO)O)O)O)C(O)3)CO)C1=O
M  END

</pre>