KEGG   COMPOUND: C19837
Entry
C19837                      Compound                               
Name
Indole-3-carboxylate;
Indole-3-carboxylic acid
Formula
C9H7NO2
Exact mass
161.0477
Mol weight
161.1574
Structure
Reaction
R09488
Enzyme
4.1.1.92
Other DBs
CAS: 771-50-6
PubChem: 135626304
KNApSAcK: C00000113
PDB-CCD: ICO[PDBj]
KCF data

ATOM        12
            1   C8x C    22.0844  -22.0228
            2   C8x C    22.0844  -23.4205
            3   C8x C    23.2948  -24.1194
            4   C8y C    24.5053  -23.4205
            5   C8y C    24.5053  -22.0228
            6   C8x C    23.2948  -21.3240
            7   N4x N    25.8346  -23.8524
            8   C8x C    26.6561  -22.7217
            9   C8y C    25.8346  -21.5910
            10  C6a C    26.2650  -20.2663
            11  O6a O    27.6421  -19.9736
            12  O6a O    25.3382  -19.2376
BOND        13
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    9  10 1
            12   10  11 1
            13   10  12 2

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  All links  
Chemical substance (4)   
   PubChem (1)   
   HMDB (1)   
   KNApSAcK (1)   
   PDB-CCD (1)   
Chemical reaction (2)   
   KEGG ENZYME (1)   
   KEGG REACTION (1)   
All databases (6)   

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