Mol:FL4DCCNS0003

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 26 28  0  0  0  0  0  0  0  0999 V2000 
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 25 26  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  25  26 
M  SBL   1  1  27 
M  SMT   1  OCH3 
M  SVB   1 27   -2.3033    0.7082 
S  SKP  8 
ID	FL4DCCNS0003 
KNApSAcK_ID	C00008744 
NAME	Padmatin 3-acetate 
CAS_RN	100595-93-5 
FORMULA	C18H16O8 
EXACTMASS	360.08451748799996 
AVERAGEMASS	360.31484 
SMILES	c(c21)(O)cc(OC)cc(O[C@H](c(c3)cc(O)c(O)c3)[C@H](C2=O)OC(C)=O)1 
M  END