Mol:BMCCPPCB0006

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Line 179: Line 179:
 
S  SKP  7  
 
S  SKP  7  
 
ID BMCCPPCB0006  
 
ID BMCCPPCB0006  
NAME Adenosyl cobyrinate hexaamide
+
NAME (2R,3R,4S,5R) -2- (6-Aminopurin-9-yl) -5-methanidyloxolane-3,4-diol; cobalt(3+) ; 3- [(2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18S,19R) -2,13,18-tris(2-amino-2-oxoethyl) -7,12,17-tris(3-amino-3-oxopropyl) -3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-24-id-3-yl] propanoic acid
 
FORMULA C55H77CoN15O11  
 
FORMULA C55H77CoN15O11  
 
EXACTMASS 1182.5258  
 
EXACTMASS 1182.5258  

Latest revision as of 10:47, 16 June 2010

BMCCPPCB0006.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
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S  SKP  7 
ID	BMCCPPCB0006 
NAME	(2R,3R,4S,5R) -2- (6-Aminopurin-9-yl) -5-methanidyloxolane-3,4-diol; cobalt(3+) ; 3- [(2R,3R,5Z,7S,10Z,12S,13S,15Z,17S,18S,19R) -2,13,18-tris(2-amino-2-oxoethyl) -7,12,17-tris(3-amino-3-oxopropyl) -3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-24-id-3-yl] propanoic acid 
FORMULA	C55H77CoN15O11 
EXACTMASS	1182.5258 
AVERAGEMASS	1183.2275 
SMILES	O=C(CC[C@H](C3=1)[C@@]([C@@](C87)(N([Co+2](N=54)(C[C@H]([C@H]%11O)O[C@H]([C@@H]%11O)n(c%10)c(n9)c(n%10)c(N)nc9)(N86)N(=C2C=C4C([C@@H](C5C(C)=C6[C@](CCC(O)=O)(C)[C@H]7CC(N)=O)CCC(N)=O)(C)C)C(=C3C)[C@@](C)([C@H](CCC(N)=O)2)CC(=O)N)1)C)(C)CC(N)=O)N 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C06507 
M  END
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