KEGG   COMPOUND: C00679Help
Entry
C00679                      Compound                               

Name
5-Dehydro-4-deoxy-D-glucarate;
(2R,3S)-2,3-Dihydroxy-5-oxohexanedioate
Formula
C6H8O7
Exact mass
192.027
Mol weight
192.1235
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00053  Ascorbate and aldarate metabolism
map01100  Metabolic pathways
Enzyme
4.1.2.20        4.2.1.40        4.2.1.41        4.2.1.42        
4.2.1.156       5.5.1.27
Other DBs
PubChem: 3948
ChEBI: 16369 42819
PDB-CCD: GLR[PDBj]
3DMET: B01308
NIKKAJI: J913.057H
KCF data Show

ATOM        13
            1   O6a O    23.3261  -18.9177
            2   C6a C    24.5385  -18.2199
            3   C1c C    25.7508  -18.9177
            4   C1c C    26.9633  -18.2199
            5   C1b C    28.1757  -18.9177
            6   C5a C    29.3811  -18.2199
            7   C6a C    30.5934  -18.9177
            8   O6a O    31.8058  -18.2199
            9   O6a O    24.5385  -16.8171
            10  O5a O    29.3811  -16.8171
            11  O6a O    30.5934  -20.3205
            12  O1a O    25.7508  -20.3205
            13  O1a O    26.9633  -16.8171
BOND        12
            1     6   7 1
            2     3   4 1
            3     7   8 1
            4     2   9 2
            5     4   5 1
            6     6  10 2
            7     2   3 1
            8     7  11 2
            9     5   6 1
            10    3  12 1 #Up
            11    1   2 1
            12    4  13 1 #Up

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