KEGG   COMPOUND: C15347
Entry
C15347                      Compound                               
Name
6-(Isopropylthio)purine
Formula
C8H10N4S
Exact mass
194.0626
Mol weight
194.2568
Structure
Other DBs
PubChem: 17396344
ChEBI: 79849
NIKKAJI: J2.793.902C
LinkDB
KCF data

ATOM        13
            1   N5x N    25.5500  -17.9900
            2   C8x C    25.5500  -19.3200
            3   N5x N    24.4300  -19.9500
            4   C8y C    23.2400  -19.3200
            5   C8y C    23.2400  -17.9900
            6   C8y C    24.4300  -17.2900
            7   S2a S    24.4300  -16.0300
            8   C1c C    25.5500  -15.3300
            9   C1a C    26.7400  -15.9600
            10  C1a C    25.5500  -13.9300
            11  N4x N    21.9751  -17.5790
            12  C8x C    21.1933  -18.6550
            13  N5x N    21.9751  -19.7310
BOND        14
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    8  10 1
            11    5  11 1
            12   11  12 1
            13   12  13 2
            14    4  13 1

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