KEGG   COMPOUND: C20643Help
Entry
C20643                      Compound                               

Name
2-Heptyl-4(1H)-quinolone;
2-Heptyl-4-quinolone;
2-Heptyl-4-hydroxyquinoline
Formula
C16H21NO
Exact mass
243.1623
Mol weight
243.344
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00405  Phenazine biosynthesis
map01130  Biosynthesis of antibiotics
map02024  Quorum sensing
map02025  Biofilm formation - Pseudomonas aeruginosa
Enzyme
Other DBs
PubChem: 172232367
ChEMBL: CHEMBL527817
PDB-CCD: HLH[PDBj]
KCF data Show

ATOM        18
            1   C8x C     5.6000  -16.2400
            2   C8x C     5.6000  -17.6400
            3   C8x C     6.8124  -18.3400
            4   C8y C     8.0249  -17.6400
            5   C8y C     8.0249  -16.2400
            6   C8x C     6.8124  -15.5400
            7   C8y C     9.2373  -18.3400
            8   C8x C    10.4497  -17.6400
            9   C8y C    10.4497  -16.2400
            10  N4x N     9.2373  -15.5400
            11  C1b C    11.6424  -15.5400
            12  C1b C    12.8549  -16.2400
            13  C1b C    14.0673  -15.5400
            14  C1b C    15.2797  -16.2400
            15  C1b C    16.4922  -15.5400
            16  C1b C    17.7046  -16.2400
            17  C1a C    18.9170  -15.5400
            18  O5x O     9.2373  -19.7400
BOND        19
            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 2
            10    9  10 1
            11    5  10 1
            12    9  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19    7  18 2

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