KEGG   COMPOUND: C02581
Entry
C02581                      Compound                               
Name
Propanoylagmatine;
Propionylagmatine
Formula
C8H18N4O
Exact mass
186.1481
Mol weight
186.2547
Structure
Other DBs
PubChem: 5576
ChEBI: 8480
NIKKAJI: J2.739.115J
KCF data

ATOM        13
            1   C1a C    14.3024  -19.1800
            2   C1b C    15.5149  -19.8800
            3   C5a C    16.7273  -19.1800
            4   N1b N    17.9397  -19.8800
            5   C1b C    19.1522  -19.1800
            6   C1b C    20.3646  -19.8800
            7   C1b C    21.5770  -19.1800
            8   C1b C    22.7895  -19.8800
            9   N1b N    24.0019  -19.1800
            10  C2c C    25.2144  -19.8800
            11  N1a N    26.4268  -19.1800
            12  N2a N    25.2144  -21.2799
            13  O5a O    16.7273  -17.7800
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12    3  13 2

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