Mol:FL7AACGL0120

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(Created page with "FL7AACGL0122.mol ChemDraw12051213093D 128139 0 0 0 0 0 0 0 0999 V2000 -1.6429 3.6987 -2.4048 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6429 4.523...")
 
 
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FL7AACGL0122.mol
 
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Copyright: ARM project http://www.metabolome.jp/
 
128139  0  0  0  0  0  0  0  0999 V2000  
 
128139  0  0  0  0  0  0  0  0999 V2000  
 
   -1.6429    3.6987  -2.4048 C  0  0  0  0  0  0  0  0  0  0  0  0  
 
   -1.6429    3.6987  -2.4048 C  0  0  0  0  0  0  0  0  0  0  0  0  
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M  CHG  1  7  1  
 
M  CHG  1  7  1  
S  SKP  5
+
S  SKP  9
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AUTODRAW FALSE
 
ID FL7AACGL0120  
 
ID FL7AACGL0120  
 +
KNApSAcK_ID
 +
NAME OVA 1
 +
CAS_RN 865377-14-6
 
FORMULA C80H89O46  
 
FORMULA C80H89O46  
 
EXACTMASS 1785.46250046  
 
EXACTMASS 1785.46250046  

Latest revision as of 13:41, 5 December 2012

FL7AACGL0120.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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M  CHG  1   7   1 
S  SKP  9 
AUTODRAW	FALSE 
ID	FL7AACGL0120 
KNApSAcK_ID	 
NAME	 OVA 1 
CAS_RN	865377-14-6 
FORMULA	C80H89O46 
EXACTMASS	1785.46250046 
AVERAGEMASS	1786.5350600000002 
SMILES	OC(C(Oc(c2)c(c4)c([o+1]c(c4OC(C(OC(C(OC(C=Cc(c%12)ccc(c%12O)OCC(O9)C(C(O)C(C9OC(C=Cc(c%11)ccc(c%11O)OC(O%10)C(C(C(O)C%10CO)O)O)=O)O)O)=O)8)OCC(C8O)O)5)OC(COC(C(=C(c(c6)ccc(OC(C7O)OC(CO)C(C7O)O)c6)[H])[H])=O)C(O)C5O)c(c3)cc(O)c(O)c3)cc2O)1)C(C(C(COC(CC(O)=O)=O)O1)O)O 
M  END
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