COMPOUND: C05828
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Entry
C05828 Compound
Name
Methylimidazoleacetic acid;
Tele-methylimidazoleacetic acid;
1-Methyl-4-imidazoleacetic acid;
1-Methylimidazole-4-acetate;
Methylimidazoleacetate
Formula
C6H8N2O2
Exact mass
140.0586
Mol weight
140.1399
Structure
Mol file
KCF file
DB search
Reaction
R04996
Pathway
map00340
Histidine metabolism
map01100
Metabolic pathways
Enzyme
1.2.1.5
Other DBs
CAS:
2625-49-2
PubChem:
8122
ChEBI:
1606
3DMET:
B00857
NIKKAJI:
J257.475F
LinkDB
All DBs
KCF data
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ATOM 10
1 C8y C 28.2255 -22.7533
2 C8x C 28.6492 -21.4240
3 N5x N 26.8126 -22.7596
4 C1b C 28.9062 -23.9604
5 N4y N 27.5126 -20.6083
6 C8x C 26.3760 -21.4240
7 C6a C 30.3124 -23.9604
8 C1a C 27.4998 -19.2020
9 O6a O 30.9996 -22.7468
10 O6a O 31.0125 -25.1678
BOND 10
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 2
6 4 7 1
7 5 8 1
8 7 9 1
9 7 10 2
10 5 6 1
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