KEGG   COMPOUND: C08733
Entry
C08733                      Compound                               
Name
Ammeline;
2-Hydroxy-4,6-diamino-1,3,5-triazine
Formula
C3H5N5O
Exact mass
127.0494
Mol weight
127.11
Structure
Reaction
R06968 R06969
Pathway
map00791  Atrazine degradation
map01120  Microbial metabolism in diverse environments
Enzyme
3.5.4.45        3.8.1.8
Other DBs
CAS: 645-92-1
PubChem: 10926
ChEBI: 28646
PDB-CCD: 6AM[PDBj]
NIKKAJI: J9.460I
LinkDB
KCF data

ATOM        9
            1   C8y C    27.6278  -18.3427
            2   N5x N    28.8400  -19.0395
            3   N5x N    27.6278  -16.9373
            4   N1a N    26.4156  -19.0395
            5   C8y C    30.0522  -18.3427
            6   C8y C    28.8400  -16.2405
            7   N5x N    30.0522  -16.9373
            8   N1a N    31.2644  -19.0395
            9   O1a O    28.8458  -14.8407
BOND        9
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     5   7 1
            7     5   8 1
            8     6   9 1
            9     6   7 2

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