COMPOUND: C02648
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Entry
C02648 Compound
Name
4-Hydroxy-2-butynal;
4-Hydroxybut-2-ynal
Formula
C4H4O2
Exact mass
84.0211
Mol weight
84.0734
Structure
Mol file
KCF file
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Reaction
R03963
Enzyme
1.1.1.165
Other DBs
PubChem:
5625
ChEBI:
16711
3DMET:
B00475
NIKKAJI:
J2.739.319E
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KCF data
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ATOM 6
1 C3b C 25.8520 -16.0530
2 C3b C 27.0680 -16.7546
3 C1b C 24.6416 -15.3514
4 C4a C 28.2784 -16.0530
5 O1a O 23.4313 -16.0530
6 O4a O 29.4887 -16.7546
BOND 5
1 1 2 3
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 2
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