Mol:FL2F19NI0005

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FL2F19NI0005.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 24 26  0  0  0  0  0  0  0  0999 V2000 
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   -1.9336    0.2801    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.4336    1.1461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
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  8  9  1  0  0  0  0 
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  7 12  2  0  0  0  0 
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  6 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  23  24 
M  SBL   1  1  25 
M  SMT   1  OCH3 
M  SVB   1 25   -1.9336    0.2801 
S  SKP  8 
ID	FL2F19NI0005 
KNApSAcK_ID	C00008393 
NAME	Isoderricin A 
CAS_RN	38965-75-2 
FORMULA	C21H22O3 
EXACTMASS	322.15689456999996 
AVERAGEMASS	322.39758 
SMILES	C(C1)(c(c3)cccc3)Oc(c(CC=C(C)C)2)c(ccc2OC)C(=O)1 
M  END
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