Mol:FLIF1LGF0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   3 SUP 
M  SLB  1   3   3 
M  SAL   3  2  36  37 
M  SBL   3  1  41 
M  SMT   3  CH2OH 
M  SVB   3 41   -3.7589     1.225 
M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  40  41 
M  SBL   2  1  45 
M  SMT   2  OCH3 
M  SVB   2 45    2.4435    -2.095 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  38  39 
M  SBL   1  1  43 
M  SMT   1  OCH3 
M  SVB   1 43    3.6278   -1.8238 
S  SKP  8 
ID	FLIF1LGF0001 
KNApSAcK_ID	C00010176 
NAME	Amorphigenin O-glucoside 
CAS_RN	23708-98-7 
FORMULA	C29H32O12 
EXACTMASS	572.189376488 
AVERAGEMASS	572.55718 
SMILES	C(O)C(O1)[C@@H]([C@H](O)[C@H](O)[C@@H]1OCC(C(O6)Cc(c65)c(c2cc5)OC(C3)C(c(c4)c(cc(OC)c4OC)O3)C2=O)=C)O 
M  END