COMPOUND: C11838
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Entry
C11838 Compound
Name
(S)-4,5-Dihydroxypentane-2,3-dione;
(4S)-4,5-Dihydroxy-2,3-pentanedione
Formula
C5H8O4
Exact mass
132.0423
Mol weight
132.1146
Structure
Mol file
KCF file
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Reaction
R01291
R11183
Enzyme
2.7.1.189
4.4.1.21
Other DBs
PubChem:
14000
ChEBI:
29484
NIKKAJI:
J1.969.645F
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KCF data
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ATOM 9
1 C1a C 21.1931 -20.2991
2 C5a C 22.4055 -19.5991
3 C5a C 23.6178 -20.2991
4 C1c C 24.8303 -19.5991
5 C1b C 26.0427 -20.2991
6 O1a O 26.0293 -21.6921
7 O1a O 24.8203 -18.1922
8 O5a O 22.3950 -18.1922
9 O5a O 23.6041 -21.6921
BOND 8
1 4 5 1
2 2 3 1
3 5 6 1
4 1 2 1
5 4 7 1 #Up
6 3 4 1
7 2 8 2
8 3 9 2
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