Mol:FL2F1AGS0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  29  30 
M  SBL   1  1  32 
M  SMT   1  CH2OH 
M  SVB   1 32   -3.0691    0.8683 
S  SKP  8 
ID	FL2F1AGS0002 
KNApSAcK_ID	C00008194 
NAME	Neoliquiritin 
CAS_RN	5088-75-5 
FORMULA	C21H22O9 
EXACTMASS	418.126382302 
AVERAGEMASS	418.39398 
SMILES	Oc(c1)ccc(C(C4)Oc(c3C(=O)4)cc(cc3)O[C@H](O2)[C@@H](O)[C@@H](O)[C@@H](O)C2CO)c1 
M  END