KEGG   COMPOUND: C20917Help
Entry
C20917                      Compound                               

Name
Tabtoxin;
beta-Tabtoxin
Formula
C11H19N3O6
Exact mass
289.1274
Mol weight
289.2851
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map00261  Monobactam biosynthesis
map01130  Biosynthesis of antibiotics
Enzyme
3.4.-.-         6.3.2.-
Other DBs
PubChem: 254741380
ChEMBL: CHEMBL3781539
KCF data Show

ATOM        20
            1   C1a C    13.1009  -16.0440
            2   C1c C    14.3144  -15.3434
            3   C1c C    15.5280  -16.0440
            4   N1b N    16.7414  -15.3434
            5   C5a C    17.9548  -16.0440
            6   C1c C    19.1685  -15.3434
            7   C1b C    20.3819  -16.0440
            8   C1b C    21.5954  -15.3434
            9   C1z C    22.8089  -16.0440
            10  O1a O    14.3144  -13.9423
            11  C6a C    15.5280  -17.4449
            12  O6a O    16.7602  -18.1566
            13  O6a O    14.3333  -18.1348
            14  O5a O    17.9548  -17.4450
            15  N1a N    19.1685  -13.9424
            16  C5x C    22.8089  -17.4448
            17  N1x N    24.2099  -17.4448
            18  C1x C    24.2099  -16.0440
            19  O5x O    21.8335  -18.4208
            20  O1a O    22.8089  -14.6440
BOND        20
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     7   8 1
            8     9   8 1 #Down
            9     2  10 1 #Up
            10    3  11 1 #Down
            11   11  12 2
            12   11  13 1
            13    5  14 2
            14    6  15 1 #Up
            15    9  16 1
            16   16  17 1
            17   17  18 1
            18    9  18 1
            19   16  19 2
            20    9  20 1 #Up

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