KEGG   COMPOUND: C02253
Entry
C02253                      Compound                               

Name
Benzoylagmatine
Formula
C12H18N4O
Exact mass
234.1481
Mol weight
234.2975
Structure
Reaction
Enzyme
Other DBs
PubChem: 5316
ChEBI: 16270
3DMET: B00412
NIKKAJI: J2.735.677J
KCF data

ATOM        17
            1   C8x C    17.7100  -21.9800
            2   C8x C    17.7100  -23.3800
            3   C8x C    18.9224  -24.0800
            4   C8x C    20.1349  -23.3800
            5   C8y C    20.1349  -21.9800
            6   C8x C    18.9224  -21.2800
            7   C5a C    21.3724  -21.2800
            8   N1b N    22.5849  -21.9800
            9   C1b C    23.7973  -21.2800
            10  C1b C    25.0097  -21.9800
            11  C1b C    26.2222  -21.2800
            12  C1b C    27.4346  -21.9800
            13  N1b N    28.6470  -21.2800
            14  C2c C    29.8595  -21.9800
            15  N1a N    31.0719  -21.2800
            16  O5a O    21.3786  -19.8803
            17  N2a N    29.8595  -23.3797
BOND        17
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16    7  16 2
            17   14  17 2

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