Mol:FLIBHXNI0001

<pre>

Copyright: ARM project http://www.metabolome.jp/
 28 30  0  0  0  0  0  0  0  0999 V2000
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    2.8475    1.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3772   -1.5188    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  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
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  7 17  2  0  0  0  0
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  8 19  1  0  0  0  0
  1 20  1  0  0  0  0
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 13 26  1  0  0  0  0
 14 27  1  0  0  0  0
 27 28  1  0  0  0  0
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  2  27  28
M  SBL   1  1  29
M  SMT   1  OCH3
M  SVB   1 29    1.8821   -0.7251
S  SKP  8
ID	FLIBHXNI0001
KNApSAcK_ID	C00009552
NAME	Secundifloran
CAS_RN	63882-44-0
FORMULA	C21H22O7
EXACTMASS	386.136553058
AVERAGEMASS	386.39518
SMILES	C=CC(C)(C)c(c1)c(c(c(c1C(O)(C2=O)COc(c3)c(ccc(O)3)2)O)O)OC
M  END

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