Mol:FL3FACCS0031

Latest revision as of 09:00, 14 March 2009

 
 
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  42  43 
M  SBL   2  1  46 
M  SMT   2  CH2OH 
M  SVB   2 46    -2.678    0.3181 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  40  41 
M  SBL   1  1  44 
M  SMT   1  CH2OH 
M  SVB   1 44   -3.2648   -1.9459 
S  SKP  8 
ID	FL3FACCS0031 
KNApSAcK_ID	C00006212 
NAME	Isoorientin 2''-O-alpha-D-mannoside 
CAS_RN	108195-77-3 
FORMULA	C27H30O16 
EXACTMASS	610.153384912 
AVERAGEMASS	610.5175 
SMILES	C([C@@H]([C@H]1O)O[C@H](O[C@@H]([C@H]2O)[C@H](c(c3O)c(cc(O4)c(C(C=C(c(c5)ccc(c5O)O)4)=O)3)O)OC([C@@H]2O)CO)C(O)C(O)1)O 
M  END