KEGG   COMPOUND: C02997
Entry
C02997                      Compound                               
Name
N-Acetyl-L-histidine
Formula
C8H11N3O3
Exact mass
197.08
Mol weight
197.1912
Structure
Reaction
Enzyme
Other DBs
CAS: 2497-02-1
PubChem: 5906
ChEBI: 16437
3DMET: B00525
NIKKAJI: J125.811G
LinkDB
KCF data

ATOM        14
            1   C8x C    20.2170  -16.5152
            2   N5x N    20.6417  -17.8493
            3   C8y C    22.0417  -17.8575
            4   C8x C    22.4822  -16.5287
            5   N4x N    21.3545  -15.6991
            6   C1b C    23.2624  -18.5500
            7   C1c C    24.4749  -17.8500
            8   C6a C    25.6873  -18.5500
            9   O6a O    26.8997  -17.8500
            10  O6a O    25.6873  -19.9500
            11  N1b N    24.4749  -16.4502
            12  C5a C    25.7061  -15.7392
            13  C1a C    26.9111  -16.4348
            14  O5a O    25.7058  -14.3501
BOND        14
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     1   5 1
            6     3   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    8  10 2
            11    7  11 1 #Down
            12   11  12 1
            13   12  13 1
            14   12  14 2

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