Mol:FL7AADGL0002

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  STY  1   2 SUP 
M  SLB  1   2   2 
M  SAL   2  2  32  33 
M  SBL   2  1  35 
M  SMT   2  CH2OH 
M  SVB   2 35    3.1365   -1.4145 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  30  31 
M  SBL   1  1  33 
M  SMT   1  OCH3 
M  SVB   1 33    0.3368     1.827 
S  SKP  8 
ID	FL7AADGL0002 
KNApSAcK_ID	C00006681 
NAME	Oxycoccicyanin;Peonidin 3-O-beta-D-glucopyranoside 
CAS_RN	6906-39-4 
FORMULA	C22H23O11 
EXACTMASS	463.124036578 
AVERAGEMASS	463.41142 
SMILES	O(c(c1)c(O)ccc1c([o+1]2)c(O[C@@H](C(O)4)O[C@H](CO)[C@@H](C4O)O)cc(c(O)3)c2cc(O)c3)C 
M  END