Mol:FL3FCCCS0001

 
 
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  30  31 
M  SBL   1  1  33 
M  SMT   1 ^OCH3 
M  SBV   1 33   -7.8584    5.0628 
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  SBV   2 35   -7.5119    4.6369 
S  SKP  8 
ID	FL3FCCCS0001 
KNApSAcK_ID	C00001102 
NAME	Swertiajaponin;Leucanthoside;6-beta-D-glucopyranosyl-3',4',5-trihydroxy-7-methoxyflavone 
CAS_RN	6980-25-2 
FORMULA	C22H22O11 
EXACTMASS	462.116211546 
AVERAGEMASS	462.40348000000006 
SMILES	C(C(=O)2)=C(Oc(c3)c2c(O)c(C(O4)C(O)C(C(C4CO)O)O)c3OC)c(c1)ccc(c1O)O 
M  END