KEGG   COMPOUND: C01756
Entry
C01756                      Compound                               

Name
Thiopurine
Formula
C5H4N4S
Exact mass
152.0157
Mol weight
152.1771
Structure
Comment
Generic compound in reaction hierarchy
Reaction
Enzyme
Other DBs
PubChem: 4889
ChEBI: 2208
ChEMBL: CHEMBL1425
PDB-CCD: PM6[PDBj]
3DMET: B00345
NIKKAJI: J2.298E
KCF data

ATOM        10
            1   C8y C    23.7300  -16.9400
            2   C8y C    23.7300  -18.3400
            3   C8y C    24.9200  -16.2400
            4   N4x N    22.4000  -16.5200
            5   N5x N    24.9200  -19.0400
            6   N5x N    22.4000  -18.7600
            7   N5x N    26.1800  -16.9400
            8   S1a S    24.9200  -14.9100
            9   C8x C    21.5600  -17.6400
            10  C8x C    26.1800  -18.3400
BOND        11
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 2
            10    6   9 2
            11    7  10 1

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