KEGG   COMPOUND: C12220
Entry
C12220                      Compound                               

Name
Myxochelin A
Formula
C20H24N2O7
Exact mass
404.1584
Mol weight
404.4138
Structure
Sequence
0 DHBA  1 Lys
  Gene
0 MxcE [UP:Q9F638] MxcF [UP:Q9F637]; 1 MxcG [UP:Q9F636]
  Organism
Stigmatella aurantiaca
  Type
NRP
Pathway
map01053  Biosynthesis of siderophore group nonribosomal peptides
Other DBs
CAS: 120243-02-9
PubChem: 14365
ChEBI: 31877
ChEMBL: CHEMBL515742
KNApSAcK: C00017648
NIKKAJI: J1.454.181K J2.378.312F
KCF data

ATOM        29
            1   C8y C    13.5845  -16.5245
            2   C8x C    13.5845  -17.9248
            3   C8x C    14.7748  -18.6250
            4   C8x C    16.0351  -17.9248
            5   C8y C    16.0351  -16.5245
            6   C8y C    14.7748  -15.8243
            7   O1a O    14.7748  -14.4240
            8   O1a O    12.3944  -15.8243
            9   C5a C    17.2954  -15.8243
            10  N1b N    18.4857  -16.5245
            11  C1c C    19.6760  -15.8243
            12  C1b C    20.9363  -16.5245
            13  C1b C    22.1266  -15.8243
            14  C1b C    23.3168  -16.5245
            15  C1b C    24.5771  -15.8243
            16  N1b N    25.7674  -16.5245
            17  C5a C    26.9576  -15.8243
            18  C8y C    28.2179  -16.5245
            19  O5a O    17.2954  -14.4940
            20  C1b C    19.6760  -14.4240
            21  O1a O    20.9363  -13.7238
            22  O5a O    26.9576  -14.4240
            23  C8x C    28.2179  -17.9248
            24  C8x C    29.4082  -18.6250
            25  C8x C    30.5985  -17.9248
            26  C8y C    30.5985  -16.5245
            27  C8y C    29.4082  -15.8243
            28  O1a O    29.4082  -14.4240
            29  O1a O    31.8588  -15.8243
BOND        30
            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     6   7 1
            8     1   8 1
            9     5   9 1
            10    9  10 1
            11   11  10 1 #Down
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 1
            19    9  19 2
            20   11  20 1
            21   20  21 1
            22   17  22 2
            23   18  23 2
            24   23  24 1
            25   24  25 2
            26   25  26 1
            27   26  27 2
            28   18  27 1
            29   27  28 1
            30   26  29 1

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