KEGG   COMPOUND: C04053
Entry
C04053                      Compound                               
Name
5-Dehydro-4-deoxy-D-glucuronate;
4-Deoxy-L-threo-5-hexosulose uronate;
(4S,5R)-4,5-Dihydroxy-2,6-dioxohexanoate
Formula
C6H8O6
Exact mass
176.0321
Mol weight
176.1241
Structure
Reaction
R04382 R04383 R06249 R09831 R10867 R13196
Pathway
map00040  Pentose and glucuronate interconversions
map01100  Metabolic pathways
Enzyme
3.2.1.179       3.2.1.180       4.2.2.6         4.2.99.25       
5.3.1.17
Other DBs
PubChem: 6754
ChEBI: 17117 17782
PDB-CCD: D54[PDBj]
3DMET: B04924
NIKKAJI: J2.745.978A
LinkDB
KCF data

ATOM        12
            1   C6a C    31.0926  -19.1965
            2   C5a C    29.9016  -19.8971
            3   C1b C    28.6405  -19.1965
            4   C1c C    27.4495  -19.8971
            5   C1c C    26.2585  -19.1965
            6   C4a C    24.9974  -19.8971
            7   O5a O    29.9016  -21.2983
            8   O6a O    32.2836  -19.8971
            9   O6a O    31.0926  -17.7953
            10  O1a O    27.4495  -21.2983
            11  O1a O    26.2585  -17.7953
            12  O4a O    23.7837  -19.1695
BOND        11
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     2   7 2
            7     1   8 1
            8     1   9 2
            9     4  10 1 #Down
            10    5  11 1 #Down
            11    6  12 2

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