COMPOUND: C06331
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Entry
C06331 Compound
Name
2-Methylquinoline-3,4-diol
Formula
C10H9NO2
Exact mass
175.0633
Mol weight
175.184
Structure
Mol file
KCF file
DB search
Reaction
R05155
Enzyme
1.13.11.48
Other DBs
PubChem:
8567
ChEBI:
1215
PDB-CCD:
HQD
[
PDBj
]
3DMET:
B00938
NIKKAJI:
J2.761.004H
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KCF data
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ATOM 13
1 C8y C 28.2513 -16.9337
2 C8y C 28.2572 -15.5292
3 C8y C 29.4637 -17.6331
4 C8x C 27.0508 -17.6274
5 N5x N 29.4754 -14.8298
6 C8x C 27.0508 -14.8238
7 C8y C 30.6819 -16.9397
8 O1a O 29.4578 -19.0261
9 C8x C 25.8326 -16.9337
10 C8y C 30.6876 -15.5408
11 C8x C 25.8326 -15.5292
12 O1a O 31.8883 -17.6448
13 C1a C 31.9000 -14.8472
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 2
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 10 1
14 9 11 1
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