COMPOUND: C06440
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Entry
C06440 Compound
Name
2-Dehydro-D-glucono-1,5-lactone
Formula
C6H8O6
Exact mass
176.0321
Mol weight
176.1241
Structure
Mol file
KCF file
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Reaction
R02659
R04048
Enzyme
1.1.3.-
Other DBs
PubChem:
8674
3DMET:
B02028
NIKKAJI:
J2.741.707H
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KCF data
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ATOM 12
1 C1y C 24.5718 -15.8568
2 C1y C 24.5718 -17.2598
3 O7x O 25.7827 -15.1522
4 C1b C 23.3608 -15.1522
5 C1y C 25.7827 -17.9526
6 O1a O 23.3608 -17.9526
7 C7x C 26.9938 -15.8568
8 O1a O 22.1439 -15.8568
9 C5x C 26.9938 -17.2598
10 O1a O 25.7827 -19.3558
11 O6a O 28.2047 -15.1522
12 O5x O 28.2047 -17.9526
BOND 12
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 1 #Up
10 7 11 2
11 9 12 2
12 7 9 1
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