COMPOUND: C01188
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Entry
C01188 Compound
Name
3-Hydroxy-2-methylpropanoate;
3-Hydroxyisobutyrate;
3-Hydroxyisobutyric acid
Formula
C4H8O3
Exact mass
104.0473
Mol weight
104.10
Structure
Mol file
KCF file
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Reaction
R02047
R03352
Enzyme
1.1.1.31
3.1.2.4
Other DBs
CAS:
2068-83-9
PubChem:
4414
ChEBI:
11805
18064
NIKKAJI:
J740.168J
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KCF data
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ATOM 7
1 C1c C 28.8747 -17.3140
2 C6a C 30.0906 -16.6125
3 C1b C 27.6704 -16.6125
4 C1a C 28.8747 -18.7053
5 O6a O 31.3007 -17.3140
6 O6a O 30.0906 -15.2037
7 O1a O 26.4545 -17.3140
BOND 6
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
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