Ketcher 12121613332D 1   1.00000     0.00000     0

 11 12  0     0  0            999 V2000
   12.9527   -4.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9527   -5.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0866   -4.0255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9038   -4.2165    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0866   -6.0255    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2206   -4.5255    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.0866   -3.0255    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.4915   -5.0255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2206   -5.5255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9038   -5.8344    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4915   -5.0255    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  2  5  2  0     0  0
  2 10  1  0     0  0
  3  6  1  0     0  0
  3  7  1  0     0  0
  4  8  2  0     0  0
  5  9  1  0     0  0
 10  8  1  0     0  0
  6  9  2  0     0  0
  8 11  1  0     0  0
M  END
> <ID>
CHEBI:134105

> <NAME>
8-hydroxyadenine

> <DEFINITION>
A nucleobase analogue that is adenine bearing a single hydroxy substituent at position 8.

> <STAR>
3

> <SYNONYM>
8-Hydroxy-1H-purin-6-amine; 6-amino-purin-8-ol; 6-amino-8-hydroxypurine

> <FORMULA>
C5H5N5O

> <MASS>
151.126

> <MONOISOTOPIC_MASS>
151.04941

> <CHARGE>
0

> <SMILES>
C=12C(=NC=NC1N)NC(=N2)O

> <INCHI>
InChI=1S/C5H5N5O/c6-3-2-4(8-1-7-3)10-5(11)9-2/h1H,(H4,6,7,8,9,10,11)

> <INCHIKEY>
RGKBRPAAQSHTED-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
21149-26-8

> <REAXYS_REGISTRY_NUMBER>
977896

> <PUBMED_CITATION>
12060667; 12665480; 13445250; 16345943; 2175601; 26188111; 6984032; 7659512

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