Mol:FL2FALNI0018

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 31 33  0  0  0  0  0  0  0  0999 V2000 
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   -2.1998    0.9019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -2.1998    1.5028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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M  STY  1   4 SUP 
M  SLB  1   4   4 
M  SAL   4  2  30  31 
M  SBL   4  1  32 
M  SMT   4  OCH3 
M  SVB   4 32    0.0463    1.2361 
M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  28  29 
M  SBL   3  1  30 
M  SMT   3  OCH3 
M  SVB   3 30   -2.5576    0.3186 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  26  27 
M  SBL   2  1  28 
M  SMT   2  OCH3 
M  SVB   2 28    2.0057    0.9253 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  24  25 
M  SBL   1  1  26 
M  SMT   1  OCH3 
M  SVB   1 26    0.4902   -0.4622 
S  SKP  8 
ID	FL2FALNI0018 
KNApSAcK_ID	C00008505 
NAME	Heteroflavanone B 
CAS_RN	151171-29-8 
FORMULA	C24H28O7 
EXACTMASS	428.18350325 
AVERAGEMASS	428.47492 
SMILES	c(c3OC)(c(cc(c3)OC)OC)C(O2)CC(c(c12)c(O)cc(OC)c(CC=C(C)C)1)=O 
M  END