KEGG   COMPOUND: C21136Help
Entry
C21136                      Compound                               

Name
Violacein
Formula
C20H13N3O3
Exact mass
343.0957
Mol weight
343.3355
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00404  Staurosporine biosynthesis
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00808  Violacein biosynthesis, tryptophan => violacein
Other DBs
CAS: 548-54-9
PubChem: 313046616
ChEBI: 131914
ChEMBL: CHEMBL1652263
KCF data Show

ATOM        26
            1   C8x C    14.2209  -19.6850
            2   C8x C    14.2209  -21.0861
            3   C8x C    15.4117  -21.7866
            4   C8y C    16.6026  -21.0861
            5   C8y C    16.6026  -19.6850
            6   C8x C    15.4117  -18.9844
            7   N1x N    17.9337  -21.5064
            8   C5x C    18.7743  -20.3855
            9   C2y C    17.9337  -19.1946
            10  C2y C    18.4240  -17.9337
            11  C2x C    19.7550  -17.4433
            12  C2y C    19.7550  -16.0422
            13  N1x N    18.4240  -15.6219
            14  C5x C    17.5834  -16.7427
            15  C8y C    20.8760  -15.2716
            16  C8x C    22.2070  -15.6920
            17  N4x N    23.0475  -14.5711
            18  C8y C    22.2070  -13.3802
            19  C8y C    20.8760  -13.8706
            20  C8x C    22.4871  -12.0492
            21  C8x C    21.4364  -11.1385
            22  C8y C    20.1053  -11.5588
            23  C8x C    19.8251  -12.8898
            24  O5x O    16.1823  -16.7427
            25  O1a O    19.0545  -10.6481
            26  O5x O    20.1754  -20.3855
BOND        30
            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 1
            10    5   9 1
            11    9  10 2
            12   10  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 1
            16   10  14 1
            17   12  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 1
            21   18  19 2
            22   15  19 1
            23   18  20 1
            24   20  21 2
            25   21  22 1
            26   22  23 2
            27   19  23 1
            28   14  24 2
            29   22  25 1
            30    8  26 2

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