KEGG   COMPOUND: C08313
Entry
C08313                      Compound                               
Name
Skatole;
3-Methylindole
Formula
C9H9N
Exact mass
131.0735
Mol weight
131.1745
Structure
Reaction
Pathway
map00380  Tryptophan metabolism
Enzyme
Other DBs
CAS: 83-34-1
PubChem: 10511
ChEBI: 9171
KNApSAcK: C00001430
NIKKAJI: J3.211E
KCF data

ATOM        10
            1   C8y C    28.0757  -19.6927
            2   C8y C    28.0873  -18.2773
            3   C8y C    29.4152  -20.1468
            4   C8x C    26.9110  -20.4149
            5   C8x C    26.9110  -17.5611
            6   N4x N    29.4385  -17.8581
            7   C8x C    30.2596  -19.0112
            8   C1a C    29.4035  -21.5622
            9   C8x C    25.7461  -19.7043
            10  C8x C    25.7461  -18.2716
BOND        11
            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   7 1
            11    9  10 1

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