Mol:FL1CALNI0002

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FL1CALNI0002.png

 
 
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 32 33  0  0  0  0  0  0  0  0999 V2000 
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  1  2  1  0  0  0  0 
  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
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 12 31  1  0  0  0  0 
 31 32  1  0  0  0  0 
M  STY  1   1 SUP 
M  SLB  1   1   1 
M  SAL   1  2  31  32 
M  SBL   1  1  32 
M  SMT   1 OCH3 
M  SBV   1 32   -7.9724    2.5333 
S  SKP  8 
ID	FL1CALNI0002 
KNApSAcK_ID	C00007148 
NAME	Kuraridin 
CAS_RN	34981-25-4 
FORMULA	C26H30O6 
EXACTMASS	438.204238692 
AVERAGEMASS	438.51279999999997 
SMILES	Oc(c1)c(C=CC(c(c2O)c(OC)cc(O)c(CC(C(C)=C)CC=C(C)C)2)=O)ccc(O)1 
M  END
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