Mol:FL7ABGGO0001

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 33 36  0  0  0  0  0  0  0  0999 V2000 
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   -1.8431   -0.5676    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.1286   -0.9801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
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  2  3  2  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  2  0  0  0  0 
  4  7  1  0  0  0  0 
  7  8  2  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
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  1 17  1  0  0  0  0 
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  3 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   -9.7997    3.9641 
S  SKP  8 
ID	FL7ABGGS0001 
KNApSAcK_ID	C00006747 
NAME	Pulchellidin 3-rhamnoside 
CAS_RN	- 
FORMULA	C22H23O11 
EXACTMASS	463.124036578 
AVERAGEMASS	463.41142 
SMILES	c(c4O)c(c(c(c4)OC)1)[o+1]c(c(c3)cc(O)c(O)c(O)3)c(OC(O2)C(C(C(O)C2C)O)O)c1 
M  END