COMPOUND: C06339
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Entry
C06339 Compound
Name
2,5,6-Trihydroxy-5,6-dihydroquinoline
Formula
C9H9NO3
Exact mass
179.0582
Mol weight
179.1727
Structure
Mol file
KCF file
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Reaction
R05157
Enzyme
1.14.12.16
Other DBs
PubChem:
8575
ChEBI:
17244
NIKKAJI:
J2.761.005F
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KCF data
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ATOM 13
1 C8y C 28.1574 -18.9637
2 C8y C 28.1633 -17.5592
3 C1y C 26.9510 -19.6631
4 C8x C 29.3697 -19.6631
5 N5x N 29.3814 -16.8656
6 C2x C 26.9510 -16.8599
7 C1y C 25.7329 -18.9637
8 O1a O 26.9569 -21.0559
9 C8x C 30.5878 -18.9754
10 C8y C 30.5935 -17.5709
11 C2x C 25.7329 -17.5592
12 O1a O 24.5265 -19.6631
13 O1a O 31.8056 -16.8832
BOND 14
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 2
10 6 11 2
11 7 12 1
12 10 13 1
13 7 11 1
14 9 10 1
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