Mol:FL7ABHGA0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 35 38  0  0  0  0  0  0  0  0999 V2000
   -2.7788    0.0430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7788   -0.5994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2225   -0.9206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6662   -0.5994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6662    0.0430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2225    0.3642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1099   -0.9206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5536   -0.5994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5536    0.0430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1099    0.3642    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    0.0025    0.3640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5695    0.0367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1365    0.3640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1365    1.0187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5695    1.3461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0025    1.0187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3349    0.3640    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0025    1.5187    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1375   -1.3201    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3654   -1.3439    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0972   -1.8084    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6130   -1.6610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1319   -1.8084    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4002   -1.3439    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8843   -1.4912    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0009   -0.9792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0260   -0.9624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4002   -0.5744    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7033    0.0368    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8529    1.9222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2943    2.8195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6589   -1.0811    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9444   -1.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4213   -2.1102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6348   -2.9071    0.0000 O   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  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  5  1  0  0  0  0
  9 11  1  0  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
  1 17  1  0  0  0  0
 14 18  1  0  0  0  0
 19  8  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  1  0  0  0
 22 23  1  1  0  0  0
 24 23  1  1  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 20 26  1  0  0  0  0
 25 27  1  0  0  0  0
 24 28  1  0  0  0  0
 21 19  1  0  0  0  0
 13 29  1  0  0  0  0
 15 30  1  0  0  0  0
 30 31  1  0  0  0  0
  3 32  1  0  0  0  0
 32 33  1  0  0  0  0
 23 34  1  0  0  0  0
 34 35  1  0  0  0  0
M  STY  1   3 SUP
M  SLB  1   3   3
M  SAL   3  2  34  35
M  SBL   3  1  37
M  SMT   3  CH2OH
M  SVB   3 37     2.538   -1.7087
M  STY  1   2 SUP
M  SLB  1   2   2
M  SAL   2  2  32  33
M  SBL   2  1  35
M  SMT   2  OCH3
M  SVB   2 35   -2.6589   -1.0811
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  30  31
M  SBL   1  1  33
M  SMT   1  OCH3
M  SVB   1 33    0.8529    1.9222
S  SKP  8
ID	FL7ABHGA0001
KNApSAcK_ID	C00006748
NAME	Europinidin 3-galactoside
CAS_RN	-
FORMULA	C23H25O12
EXACTMASS	493.134601264
AVERAGEMASS	493.4374
SMILES	[C@@H](Oc(c3)c([o+1]c(c4)c(c(cc4O)OC)3)c(c2)cc(OC)c(O)c(O)2)(C(O)1)O[C@H](CO)[C@@H](C1O)O
M  END

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