Mol:FLIHBBNI0001

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FLIHBBNI0001.png

<pre>

Copyright: ARM project http://www.metabolome.jp/
 33 36  0  0  0  0  0  0  0  0999 V2000
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  1  2  2  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  2  0  0  0  0
  6  1  1  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  1  0  0  0  0
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  1 11  1  0  0  0  0
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 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 16  1  0  0  0  0
 12 21  1  1  0  0  0
 12 22  1  6  0  0  0
  6 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 25 27  1  0  0  0  0
  7 28  1  0  0  0  0
  9 29  2  0  0  0  0
 18 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
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  SBV   1 33   -4.6939    3.7596
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  SBV   2 35   -5.1828    4.0360
S  SKP  8
ID	FLIHBBNI0001
KNApSAcK_ID	C00002543
NAME	Lonchocarpenin
CAS_RN	22263-56-5
FORMULA	C27H28O6
EXACTMASS	448.188588628
AVERAGEMASS	448.50762000000003
SMILES	c(c4)c(ccc(OC)4)C(=C(O)1)C(=O)Oc(c(CC=C(C)C)2)c1c(c(C=3)c(OC(C)(C)C3)2)OC
M  END

</pre>

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