KEGG   COMPOUND: C04575
Entry
C04575                      Compound                               
Name
(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate;
2,3-Diketo-L-gulonate;
2,3-Diketo-L-gulonic acid;
(4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoic acid
Formula
C6H8O7
Exact mass
192.027
Mol weight
192.1235
Structure
Reaction
Pathway
map00040  Pentose and glucuronate interconversions
map00053  Ascorbate and aldarate metabolism
map01100  Metabolic pathways
Enzyme
1.1.1.130       3.1.1.17        4.1.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA01 Fatty Acids and Conjugates
   FA0106 Oxo fatty acids
    C04575  (4R,5S)-4,5,6-Trihydroxy-2,3-dioxohexanoate
Other DBs
PubChem: 7176
ChEBI: 15622
LIPIDMAPS: LMFA01060195
3DMET: B01760
NIKKAJI: J156.563J
KCF data

ATOM        13
            1   C5a C    18.6433  -16.8613
            2   C1c C    17.4333  -17.5626
            3   C5a C    19.8533  -17.5626
            4   O5a O    18.6433  -15.4646
            5   C1c C    16.2170  -16.8613
            6   O1a O    17.4333  -18.9656
            7   C6a C    21.0696  -16.8613
            8   O5a O    19.8533  -18.9656
            9   C1b C    15.0070  -17.5626
            10  O1a O    16.2170  -15.4646
            11  O6a O    22.2795  -17.5692
            12  O6a O    21.0632  -15.4646
            13  O1a O    13.7970  -16.8613
BOND        12
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     3   8 2
            8     5   9 1
            9     5  10 1 #Down
            10    7  11 1
            11    7  12 2
            12    9  13 1

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