COMPOUND: C04259
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Entry
C04259 Compound
Name
N,N-Dimethylhistidine;
Nalpha,Nalpha-Dimethyl-L-histidine
Formula
C8H13N3O2
Exact mass
183.1008
Mol weight
183.2077
Structure
Mol file
KCF file
DB search
Reaction
R04436
R10524
Enzyme
2.1.1.44
Other DBs
CAS:
24940-57-6
PubChem:
6924
ChEBI:
16029
PDB-CCD:
AVI
[
PDBj
]
NIKKAJI:
J2.749.606G
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KCF data
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ATOM 13
1 C8x C 15.7324 -17.6594
2 N5x N 16.1798 -18.9860
3 C8y C 17.5797 -18.9704
4 C8x C 17.9975 -17.6341
5 N4x N 16.8557 -16.8239
6 C1b C 18.7824 -19.6700
7 C1c C 19.9949 -18.9700
8 C6a C 21.2073 -19.6700
9 O6a O 22.4197 -18.9700
10 O6a O 21.2073 -21.0700
11 N1c N 19.9949 -17.5702
12 C1a C 21.2261 -16.8592
13 C1a C 18.8013 -16.8810
BOND 13
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 11 13 1
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