Mol:KOX00233

 
 
Copyright: ARM PROJECT http://www.metabolome.jp/ 
 25 25  0  0  1  0  0  0  0  0999 V2000 
    3.1977   -8.3862    0.0000 C   0  0  3  1  0  0  0  0  0  0  0  0 
    0.5154   -8.3862    0.0000 C   0  0  3  1  0  0  0  0  0  0  0  0 
    1.8621  -10.6883    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    5.4914   -7.0589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -1.8018   -7.0589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    7.8169   -8.3862    0.0000 N   0  0  0  1  0  0  0  0  0  0  0  0 
    5.4914   -4.3690    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   -4.0609   -8.3010    0.0000 O   0  0  0  1  0  0  0  0  0  0  0  0 
   -1.8483   -4.2837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    9.8467   -6.6474    0.0000 C   0  0  3  1  0  0  0  0  0  0  0  0 
   12.3579   -7.5480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    9.3500   -4.0156    0.0000 C   0  0  0  2  0  0  0  0  0  0  0  0 
   12.8629  -10.1486    0.0000 N   0  0  0  1  0  0  0  0  0  0  0  0 
   14.3960   -5.8092    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
   11.3839   -2.2768    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
   10.5921  -11.4682    0.0000 C   0  0  0  2  0  0  0  0  0  0  0  0 
   13.9145   -3.1733    0.0000 C   0  0  0  3  0  0  0  0  0  0  0  0 
   10.9025    0.3473    0.0000 C   0  0  0  3  0  0  0  0  0  0  0  0 
   11.1040  -14.1505    0.0000 C   0  0  0  2  0  0  0  0  0  0  0  0 
    8.7986  -15.5596    0.0000 C   0  0  0  2  0  0  0  0  0  0  0  0 
    9.3383  -18.1602    0.0000 C   0  0  0  2  0  0  0  0  0  0  0  0 
    7.0362  -19.5415    0.0000 N   0  0  0  1  0  0  0  0  0  0  0  0 
    4.9559  -17.8145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.4870  -18.7268    0.0000 N   0  0  0  2  0  0  0  0  0  0  0  0 
    5.2974  -15.1557    0.0000 N   0  0  0  1  0  0  0  0  0  0  0  0 
  1  2  1  0  0  0  0 
  1  3  1  4  0  0  0 
  1  4  1  0  0  0  0 
  2  5  1  0  0  0  0 
  4  6  1  0  0  0  0 
  4  7  2  0  0  0  0 
  5  8  1  0  0  0  0 
  5  9  2  0  0  0  0 
 10  6  1  4  0  0  0 
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 12 15  1  0  0  0  0 
 13 16  1  0  0  0  0 
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 19 20  1  0  0  0  0 
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 22 23  1  0  0  0  0 
 23 24  1  0  0  0  0 
 23 25  2  0  0  0  0 
  2  3  1  4  0  0  0 
S  SKP  8 
CAS_RN	66701-25-5 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C01341 
NAME	E-6 
ID	KOX00233 
FORMULA	C15H27N5O5 
EXACTMASS	357.201218999 
AVERAGEMASS	357.40558000000004 
SMILES	NC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)C(O1)C(C(O)=O)1 
M  END