KEGG   COMPOUND: C00618
Entry
C00618                      Compound                               
Name
3-Dehydro-L-gulonate
Formula
C6H10O7
Exact mass
194.0427
Mol weight
194.14
Structure
Reaction
R01905 R02637 R02639 R02640 R07127
Pathway
map00040  Pentose and glucuronate interconversions
map00053  Ascorbate and aldarate metabolism
map01100  Metabolic pathways
Module
M00014  Glucuronate pathway (uronate pathway)
Enzyme
1.1.1.45        1.1.1.130       2.7.1.53        4.1.1.34
Other DBs
PubChem: 3892
ChEBI: 16142
NIKKAJI: J2.729.793E
LinkDB
KCF data

ATOM        13
            1   O1a O    18.2700  -19.9500
            2   C1b C    19.4824  -19.2500
            3   C1c C    20.6949  -19.9500
            4   C1c C    21.9073  -19.2500
            5   C5a C    23.1197  -19.9500
            6   C1c C    24.3322  -19.2500
            7   C6a C    25.5446  -19.9500
            8   O6a O    26.7570  -19.2500
            9   O6a O    25.5446  -21.3500
            10  O5a O    23.1197  -21.3499
            11  O1a O    21.9073  -17.8500
            12  O1a O    20.6949  -21.3498
            13  O1a O    24.3322  -17.8503
BOND        12
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     7   9 2
            9     5  10 2
            10    4  11 1 #Up
            11    3  12 1 #Up
            12    6  13 1 #Down

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