COMPOUND: C02845
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Entry
C02845 Compound
Name
Methyl ethyl ketone;
Ethyl methyl ketone;
2-Butanone;
Butan-2-one;
MEK
Formula
C4H8O
Exact mass
72.0575
Mol weight
72.11
Structure
Mol file
KCF file
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Reaction
R09358
Enzyme
4.1.2.46
Brite
Lipids [BR:
br08002
]
FA Fatty acyls
FA12 Oxygenated hydrocarbons
C02845 Butan-2-one
BRITE hierarchy
Other DBs
CAS:
78-93-3
PubChem:
5784
ChEBI:
28398
LIPIDMAPS:
LMFA12000043
NIKKAJI:
J1.960G
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KCF data
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ATOM 5
1 C5a C 17.7877 -15.1200
2 C1b C 18.9968 -15.8210
3 C1a C 16.5723 -15.8210
4 O5a O 17.7877 -13.7181
5 C1a C 20.2056 -15.1200
BOND 4
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
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