KEGG   COMPOUND: C19688
Entry
C19688                      Compound                               
Name
2-Imino-3-(7-chloroindol-3-yl)propanoate;
7-Chlorodehydrotryptophan
Formula
C11H9ClN2O2
Exact mass
236.0353
Mol weight
236.65
Structure
Reaction
R09560 R09566
Pathway
map00404  Staurosporine biosynthesis
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00789  Rebeccamycin biosynthesis, tryptophan => rebeccamycin
Enzyme
1.4.3.23        1.21.98.2
Other DBs
PubChem: 135626156
LinkDB
KCF data

ATOM        16
            1   C8y C    19.3391  -17.5149
            2   C8y C    20.6703  -17.7952
            3   C8y C    18.6385  -18.7059
            4   C8x C    18.6385  -16.2538
            5   C1b C    21.7212  -16.9544
            6   C8x C    20.7403  -19.1964
            7   N4x N    19.4792  -19.7569
            8   C8y C    17.1672  -18.7059
            9   C8x C    17.2372  -16.2538
            10  C2c C    22.9823  -17.5850
            11  C8x C    16.4666  -17.5149
            12  N2a N    22.9823  -19.0563
            13  C6a C    24.1733  -16.9544
            14  O6a O    25.3644  -17.6550
            15  O6a O    24.1733  -15.5532
            16  X   Cl   16.4740  -19.9178
BOND        17
            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 1
            10    8  11 2
            11   10  12 2
            12   10  13 1
            13   13  14 1
            14   13  15 2
            15    6   7 1
            16    9  11 1
            17    8  16 1

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