KEGG   COMPOUND: C06325
Entry
C06325                      Compound                               
Name
2-Quinolinecarboxylic acid;
Quinaldinic acid;
Quinaldic acid;
2-Quinolinecarboxylate;
Quinaldate
Formula
C10H7NO2
Exact mass
173.0477
Mol weight
173.1681
Structure
Reaction
Enzyme
Other DBs
CAS: 93-10-7
PubChem: 8561
ChEBI: 18386
PDB-CCD: QNC[PDBj]
3DMET: B00933
NIKKAJI: J4.668J
KCF data

ATOM        13
            1   C8y C    23.6556  -17.4539
            2   C8y C    23.6556  -18.8574
            3   N5x N    24.8495  -16.7550
            4   C8x C    22.4268  -16.7493
            5   C8x C    24.8495  -19.5562
            6   C8x C    22.4384  -19.5679
            7   C8y C    26.0667  -17.4539
            8   C8x C    21.2038  -17.4480
            9   C8x C    26.0667  -18.8574
            10  C8x C    21.2155  -18.8633
            11  C6a C    27.2665  -16.7550
            12  O6a O    28.4603  -17.4539
            13  O6a O    27.3306  -15.3689
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     4   8 2
            8     5   9 2
            9     6  10 2
            10    7  11 1
            11   11  12 1
            12   11  13 2
            13    7   9 1
            14    8  10 1

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