Mol:KOX00120

 
 
Copyright: ARM PROJECT http://www.metabolome.jp/ 
 17 19  0  0  0  0  0  0  0  0999 V2000 
    5.1504  -13.3490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4324  -12.9276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.1435  -14.1773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.9408  -13.0966    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    4.4324  -12.0992    0.0000 N   0  0  0  1  0  0  0  0  0  0  0  0 
    3.7111  -13.3387    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    5.9270  -14.4393    0.0000 N   0  0  0  1  0  0  0  0  0  0  0  0 
    4.4221  -14.5876    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0 
    6.4242  -13.7732    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
    5.1539  -11.6855    0.0000 C   0  0  0  2  0  0  0  0  0  0  0  0 
    3.7042  -14.1669    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
    5.1470  -10.8572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    5.8593  -10.4377    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
    5.8524   -9.6093    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
    5.1310   -9.2032    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
    4.4165   -9.6213    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
    4.4234  -10.4497    0.0000 C   0  0  0  1  0  0  0  0  0  0  0  0 
  2  6  2  0  0  0  0 
  3  7  1  0  0  0  0 
  3  8  1  0  0  0  0 
  4  9  2  0  0  0  0 
  5 10  1  0  0  0  0 
  6 11  1  0  0  0  0 
 10 12  1  0  0  0  0 
  7  9  1  0  0  0  0 
  8 11  2  0  0  0  0 
  1  2  1  0  0  0  0 
  1  3  2  0  0  0  0 
  1  4  1  0  0  0  0 
  2  5  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
S  SKP  8 
CAS_RN	1214-39-7 
KEGG	http://www.genome.jp/dbget-bin/www_bget?compound+C11263 
NAME	6-Benzylaminopurine 
ID	KOX00120 
FORMULA	C12H11N5 
EXACTMASS	225.101445377 
AVERAGEMASS	225.24944000000002 
SMILES	c(c3)ccc(c3)CNc(n2)c(n1)c(nc2)nc1 
M  END