Mol:FL3FACCSS001

 
 
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  35  36 
M  SBL   1  1  38 
M  SMT   1  CH2OH 
M  SVB   1 38   -0.2383    1.1034 
S  SKP  8 
ID	FL3FACCSS001 
KNApSAcK_ID	C00006084 
NAME	Orientin 7-O-sulfate 
CAS_RN	- 
FORMULA	C21H20O14S 
EXACTMASS	528.057376038 
AVERAGEMASS	528.4411 
SMILES	c(c(OS(O)(=O)=O)1)c(c(C(=O)4)c(OC(=C4)c(c3)cc(c(O)c3)O)c1[C@@H]([C@H]2O)OC(CO)[C@@H]([C@@H]2O)O)O 
M  END