KEGG   COMPOUND: C06732
Entry
C06732                      Compound                               
Name
alpha,beta-Didehydrotryptophan
Formula
C11H10N2O2
Exact mass
202.0742
Mol weight
202.2093
Structure
Reaction
Enzyme
Other DBs
CAS: 57361-88-3
PubChem: 8954
ChEBI: 15802
PDB-CCD: TRY[PDBj]
3DMET: B01037
NIKKAJI: J11.739K J2.763.851A
KCF data

ATOM        15
            1   C8y C    22.3469  -16.8393
            2   C8y C    23.6696  -17.1178
            3   C8y C    21.6508  -18.0227
            4   C8x C    21.6508  -15.5862
            5   C2b C    24.7138  -16.2824
            6   C8x C    23.7392  -18.5100
            7   N4x N    22.4862  -19.0670
            8   C8x C    20.1193  -18.0227
            9   C8x C    20.1889  -15.5862
            10  C2c C    25.9669  -16.9089
            11  C8x C    19.4231  -16.8393
            12  N1a N    25.9669  -18.3708
            13  C6a C    27.1503  -16.2824
            14  O6a O    28.3337  -16.9785
            15  O6a O    27.1503  -14.8901
BOND        16
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 2
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 2
            10    8  11 2
            11   10  12 1
            12   10  13 1
            13   13  14 1
            14   13  15 2
            15    6   7 1
            16    9  11 1

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