Mol:FL63ACGS0016

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FL63ACGS0016.png

 
 
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M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  31  32 
M  SBL   1  1  34 
M  SMT   1  CH2OH 
M  SVB   1 34   -2.7224    0.7156 
S  SKP  8 
ID	FL63ACGS0016 
KNApSAcK_ID	C00008852 
NAME	Catechin 7-O-beta-D-glucopyranoside 
CAS_RN	65597-47-9 
FORMULA	C21H24O11 
EXACTMASS	452.13186161 
AVERAGEMASS	452.40866 
SMILES	c(c4)(cc(c(O)c4)O)[C@@H](O3)[C@@H](O)Cc(c13)c(cc(O[C@H](O2)[C@@H](O)[C@@H](O)[C@@H](O)C2CO)c1)O 
M  END
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