COMPOUND: C16716
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Entry
C16716 Compound
Name
4-Hydroxy-2-quinolone;
4-Hydroxy-2(1H)-quinolone;
2,4-Dihydroxyquinoline
Formula
C9H7NO2
Exact mass
161.0477
Mol weight
161.1574
Structure
Mol file
KCF file
DB search
Reaction
R08473
R08474
Pathway
map00996
Biosynthesis of various alkaloids
map01063
Biosynthesis of alkaloids derived from shikimate pathway
Other DBs
CAS:
86-95-3
PubChem:
96023240
ChEBI:
75926
KNApSAcK:
C00026388
NIKKAJI:
J3.897K
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All DBs
KCF data
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ATOM 12
1 C8x C 14.9100 -15.7500
2 C8x C 14.9100 -17.1500
3 C8x C 16.1224 -17.8500
4 C8y C 17.3349 -17.1500
5 C8y C 17.3349 -15.7500
6 C8x C 16.1224 -15.0500
7 N4x N 18.5473 -17.8500
8 C8y C 19.7597 -17.1500
9 C8x C 19.7597 -15.7500
10 C8y C 18.5473 -15.0500
11 O1a O 18.5473 -13.6500
12 O5x O 20.9573 -17.8415
BOND 13
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 5 10 1
12 10 11 1
13 8 12 2
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