COMPOUND: C04575
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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
192.0270
Mol weight
192.12
Structure
Mol file
KCF file
DB search
Reaction
R02637
R02639
R04515
R04784
R04785
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
BRITE hierarchy
Other DBs
PubChem:
7176
ChEBI:
15622
LIPIDMAPS:
LMFA01060195
NIKKAJI:
J156.563J
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KCF data
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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
ยป Japanese version
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