Mol:FLIAALNP0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 36  0  0  0  0  0  0  0  0999 V2000 
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 16 32  1  0  0  0  0 
 32 33  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  32  33 
M  SBL   1  1  35 
M  SMT   1 OCH3 
M  SBV   1 35   -5.0285    4.7161 
S  SKP  8 
ID	FLIAALNP0001 
KNApSAcK_ID	C00009448 
NAME	Cajaisoflavone 
CAS_RN	72578-99-5 
FORMULA	C26H26O7 
EXACTMASS	450.167853186 
AVERAGEMASS	450.48043999999993 
SMILES	c(c32)c(c(c(c2C(=O)C(c(c(OC)4)c(O)c(CC=C(C)C)c(O)c4)=CO3)O)1)OC(C=C1)(C)C 
M  END