KEGG   COMPOUND: C16624
Entry
C16624                      Compound                               

Name
Isoniazid pyruvate
Formula
C9H9N3O3
Exact mass
207.0644
Mol weight
207.1861
Structure
Reaction
Pathway
map00983  Drug metabolism - other enzymes
Other DBs
CAS: 1081-50-1
PubChem: 51090950
ChEBI: 80618
ChEMBL: CHEMBL2111041
NIKKAJI: J27.998F
KCF data

ATOM        15
            1   C8y C    21.9515  -20.1678
            2   C5a C    23.1680  -20.8696
            3   C8x C    20.7407  -20.8696
            4   C8x C    21.9515  -18.7640
            5   N1b N    24.3846  -20.1678
            6   O5a O    23.1680  -22.2734
            7   C8x C    19.5182  -20.1678
            8   C8x C    20.7407  -18.0563
            9   N2b N    25.6071  -20.8696
            10  N5x N    19.5182  -18.7640
            11  C2c C    26.8076  -20.1724
            12  C6a C    28.0054  -20.8602
            13  C1a C    26.8041  -18.7626
            14  O6a O    29.1949  -20.1693
            15  O6a O    28.0088  -22.2600
BOND        15
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     4   8 2
            8     5   9 1
            9     7  10 2
            10    8  10 1
            11    9  11 2
            12   11  12 1
            13   11  13 1
            14   12  14 1
            15   12  15 2

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