KEGG   COMPOUND: C01152
Entry
C01152                      Compound                               
Name
N(pi)-Methyl-L-histidine;
N-pros-Methyl-L-histidine;
3-Methylhistidine;
1-Methylhistidine
Formula
C7H11N3O2
Exact mass
169.0851
Mol weight
169.1811
Structure
Reaction
Pathway
map00340  Histidine metabolism
map01100  Metabolic pathways
Enzyme
2.1.1.-         3.4.13.5        3.4.13.20       6.3.2.11
Other DBs
CAS: 368-16-1
PubChem: 4381
ChEBI: 27596
PDB-CCD: MHS[PDBj]
3DMET: B01394
NIKKAJI: J111.364J
LinkDB
KCF data

ATOM        12
            1   C8x C    23.8316  -20.7956
            2   N4y N    24.2821  -22.1196
            3   C8y C    25.6805  -22.1005
            4   C8x C    26.0943  -20.7645
            5   N5x N    24.9517  -19.9580
            6   C1b C    26.8793  -22.8005
            7   C1c C    28.0905  -22.1012
            8   C6a C    29.3017  -22.8005
            9   O6a O    30.5150  -22.1000
            10  N1a N    28.0905  -20.7028
            11  O6a O    29.3017  -24.1991
            12  C1a C    23.2921  -23.1096
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     1   5 2
            6     3   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    7  10 1 #Down
            11    8  11 2
            12    2  12 1

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