KEGG   COMPOUND: C20799
Entry
C20799                      Compound                               
Name
Grixazone B
Formula
C18H15N3O7S
Exact mass
417.0631
Mol weight
417.3926
Structure
Reaction
Pathway
map00997  Biosynthesis of various other secondary metabolites
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00905  Grixazone biosynthesis, aspartate 4-semialdehyde => grixazone B
Enzyme
Other DBs
PubChem: 254741266
LinkDB
KCF data

ATOM        29
            1   C8y C     9.1700  -16.3800
            2   C8x C     9.1700  -17.7800
            3   C8x C    10.3824  -18.4800
            4   C8y C    11.5949  -17.7800
            5   C8y C    11.5949  -16.3800
            6   C8x C    10.3824  -15.6800
            7   O2x O    12.8073  -18.4800
            8   C8y C    14.0197  -17.7800
            9   C8y C    14.0197  -16.3800
            10  N5x N    12.8073  -15.6800
            11  C8x C    15.2322  -18.4800
            12  C8y C    16.4446  -17.7800
            13  C8y C    16.4446  -16.3800
            14  C8y C    15.2322  -15.6800
            15  O5x O    17.6611  -18.4823
            16  N1a N    17.6611  -15.6777
            17  S2a S    15.2322  -14.2803
            18  C6a C     7.9576  -15.6800
            19  C1b C    16.4654  -13.5680
            20  C1c C    16.4654  -12.1680
            21  C6a C    17.6611  -11.4777
            22  O6a O    18.8586  -12.1693
            23  O6a O    17.6612  -10.0802
            24  N1b N    15.2468  -11.4643
            25  C5a C    14.0376  -12.1624
            26  C1a C    12.8571  -11.4808
            27  O5a O    14.0371  -13.5796
            28  O6a O     6.7621  -16.3704
            29  O6a O     7.9575  -14.2802
BOND        31
            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 1
            10    9  10 2
            11    5  10 1
            12    8  11 2
            13   11  12 1
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17   12  15 2
            18   13  16 1
            19   14  17 1
            20    1  18 1
            21   17  19 1
            22   20  19 1 #Down
            23   20  21 1
            24   21  22 1
            25   21  23 2
            26   20  24 1
            27   24  25 1
            28   25  26 1
            29   25  27 2
            30   18  28 1
            31   18  29 2

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