Mol:BMCCPPBL0003

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BMCCPPBL0003.png

 
 
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 11 22  1  0 
 16 23  1  1 
  4 20  1  1 
  4  3  1  0 
  3  2  2  0 
  1 20  1  0 
 14 15  1  0 
  4  5  1  0 
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  1 36  2  0 
  7  6  2  0 
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 12 11  2  0 
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  7 27  1  0 
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 39 43  2  0 
S  SKP  7 
ID	BMCCPPBL0003 
NAME	3- [2- [ [3- (2-Carboxyethyl) -5- [(4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl) methyl] -4-methyl-1H-pyrrol-2-yl] methyl] -5- [(3-ethyl-4-methyl-5-oxo-1,2-dihydropyrrol-2-yl) methyl] -4-methyl-1H-pyrrol-3-yl] propanoicacid 
CAS_RN	 17208-65-0 
FORMULA	C33H42N4O6 
EXACTMASS	590.310435096 
AVERAGEMASS	590.70994 
SMILES	C(C=1CC)(Cc(c4C)nc(c4CCC(O)=O)Cc(c(CCC(O)=O)2)nc(CC(C(C)=3)NC(C3C=C)=O)c2C)NC(=O)C1C 
SMILES	C(C=1CC)(Cc(c4C)nc(c4CCC(O)=O)Cc(c(CCC(O)=O)2)nc(CC(C(C)=3)NC(C3C=C)=O)c2C)NC(=O)C1C 
SMILES	C(C=1CC)(Cc(c4C)nc(c4CCC(O)=O)Cc(c(CCC(O)=O)2)nc(CC(C(C)=3)NC(C3C=C)=O)c2C)NC(=O)C1C 
M  END
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