KEGG   COMPOUND: C18846
Entry
C18846                      Compound                               
Name
Mycinamicin IV
Formula
C37H61NO11
Exact mass
695.4245
Mol weight
695.8803
Structure
Reaction
Pathway
map00522  Biosynthesis of 12-, 14- and 16-membered macrolides
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00934  Mycinamicin biosynthesis, malonyl-CoA + methylmalonyl-CoA => protomycinolide IV => mycinamicin II
Enzyme
1.14.13.-       2.1.1.237
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK04 Macrolides and lactone polyketides
   C18846  Mycinamicin IV
Other DBs
CAS: 73684-71-6
PubChem: 135626100
KNApSAcK: C00018284
PDB-CCD: MIV[PDBj]
KCF data

ATOM        49
            1   C2x C    18.7834  -21.5853
            2   C1y C    18.7834  -22.9820
            3   C1y C    19.9705  -23.6804
            4   O7x O    21.2275  -22.9820
            5   C2x C    19.9705  -20.8870
            6   C2x C    21.2275  -18.7920
            7   C2x C    19.9705  -19.4903
            8   C1y C    23.6019  -18.7920
            9   C1x C    23.6019  -17.3953
            10  C1y C    22.4147  -16.6970
            11  C5x C    21.2275  -17.3953
            12  C2x C    23.6019  -21.5853
            13  C1y C    24.8589  -20.8870
            14  C1y C    24.8589  -19.4903
            15  C7x C    22.4147  -23.6804
            16  C2x C    23.6019  -22.9820
            17  O5x O    20.0404  -16.6970
            18  C1b C    19.9705  -25.1469
            19  C1a C    18.7834  -25.8452
            20  O6a O    22.4147  -25.1469
            21  C1a C    25.9763  -21.5853
            22  C1a C    22.4147  -19.4903
            23  C1a C    22.4147  -15.3003
            24  C1b C    17.5962  -23.6804
            25  O2a O    16.4090  -22.9820
            26  C1y C    15.2218  -23.6804
            27  C1y C    12.7776  -23.6804
            28  C1y C    12.7776  -25.1469
            29  C1y C    13.9648  -25.8452
            30  C1y C    15.2218  -25.1469
            31  O2x O    13.9648  -22.9820
            32  C1a C    11.5905  -22.9820
            33  O1a O    11.5905  -25.8452
            34  O2a O    13.9648  -27.2419
            35  O2a O    16.4788  -25.8452
            36  C1a C    16.4788  -27.2419
            37  O2a O    25.9763  -18.7920
            38  C1y C    27.3729  -18.7920
            39  C1y C    28.0713  -19.9792
            40  C1y C    29.4680  -19.9792
            41  C1x C    30.1663  -18.7920
            42  C1y C    29.4680  -17.5350
            43  O2x O    28.0713  -17.5350
            44  C1a C    30.1663  -16.3478
            45  N1c N    30.1663  -21.2362
            46  O1a O    27.3729  -21.2362
            47  C1a C    31.5630  -21.2362
            48  C1a C    29.4680  -22.4234
            49  C1a C    12.7776  -27.9402
BOND        51
            1     2  24 1 #Up
            2     1   2 1
            3     2   3 1
            4     3   4 1
            5     1   5 2
            6     6   7 2
            7     5   7 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11    6  11 1
            12   12  13 1
            13   13  14 1
            14   14   8 1
            15    4  15 1
            16   15  16 1
            17   12  16 2
            18   11  17 2
            19    3  18 1 #Down
            20   18  19 1
            21   15  20 2
            22   13  21 1 #Up
            23    8  22 1 #Up
            24   10  23 1 #Down
            25   24  25 1
            26   26  25 1 #Up
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  26 1
            31   26  31 1
            32   27  31 1
            33   27  32 1 #Up
            34   28  33 1 #Down
            35   29  34 1 #Down
            36   30  35 1 #Down
            37   35  36 1
            38   14  37 1 #Down
            39   38  37 1 #Down
            40   39  40 1
            41   40  41 1
            42   41  42 1
            43   42  43 1
            44   43  38 1
            45   39  38 1
            46   42  44 1 #Down
            47   40  45 1 #Down
            48   39  46 1 #Up
            49   45  47 1
            50   45  48 1
            51   34  49 1

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