KEGG   COMPOUND: C02400Help
Entry
C02400                      Compound                               

Name
Demethylmacrocin;
2'''-O-Demethyllactenocin
Formula
C44H73NO17
Exact mass
887.4879
Mol weight
888.0469
Structure
Mol fileKCF fileDB search
Sequence
0 Mtk  1 Mtd  2 Mtd  3 Man  4 Mte  5 Etk  6 Mtk  7 Man
  Gene
0-2 tylG [UP:O33954]; 3 tylG [UP:O33955]; 4-5 tylG [UP:O33956];
6 tylG [UP:O33957]; 7 tylG [UP:O33958]
  Organism
Actinomycetes; Streptomyces fradiae
  Type
PK
Reaction
Pathway
map00522  Biosynthesis of 12-, 14- and 16-membered macrolides
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00773  Tylosin biosynthesis, methylmalonyl-CoA + malonyl-CoA => tylactone => tylosin
Enzyme
2.1.1.102       2.4.1.318
Other DBs
PubChem: 5434
ChEBI: 15906
KNApSAcK: C00018437
3DMET: B01570
NIKKAJI: J138.421J
KCF data Show

ATOM        62
            1   C1y C    28.5122  -18.5264
            2   C1y C    29.6230  -19.1870
            3   O2a O    27.5010  -19.8007
            4   C1y C    28.5122  -17.2520
            5   C1y C    30.7336  -18.5264
            6   N1c N    29.6230  -20.4672
            7   C1y C    25.8874  -21.0576
            8   O2x O    29.6230  -16.6207
            9   C1a C    27.4074  -16.6207
            10  C1y C    30.7336  -17.2520
            11  O1a O    31.8560  -19.1870
            12  C1a C    28.4714  -21.5779
            13  C1a C    30.9382  -21.7298
            14  C1x C    25.8874  -22.3437
            15  O2x O    24.7534  -20.4204
            16  O2a O    32.6803  -15.3170
            17  C1z C    24.7534  -22.9867
            18  C1y C    23.6426  -21.0576
            19  C1y C    30.6870  -12.8325
            20  C1y C    23.6426  -22.3437
            21  C1a C    25.6944  -23.9922
            22  O1a O    23.9057  -24.0975
            23  C1a C    22.5435  -20.4204
            24  C1y C    30.6753  -11.5113
            25  C1y C    29.5586  -13.4930
            26  O1a O    22.5435  -22.9867
            27  C1x C    29.5411  -10.8681
            28  C1b C    31.7918  -10.8566
            29  C1y C    29.5645  -14.8258
            30  C1a C    28.5998  -12.6747
            31  C1y C    29.5411   -9.5763
            32  C4a C    32.9026  -11.4996
            33  C1x C    28.4186  -15.4806
            34  O1a O    30.6753  -15.4572
            35  C5x C    28.4129   -8.9450
            36  C1a C    30.6402   -8.9390
            37  O4a O    34.0132  -10.8332
            38  C7x C    27.2846  -14.7790
            39  C2x C    27.3021   -9.5763
            40  O5x O    28.4129   -7.6472
            41  O7x O    26.1447  -15.4339
            42  O6a O    27.2670  -13.4872
            43  C2x C    27.3021  -10.8681
            44  C1y C    24.9639  -14.7616
            45  C2y C    26.0922  -11.5113
            46  C1y C    25.0163  -13.4755
            47  C1b C    23.8823  -15.4163
            48  C2x C    26.1447  -12.8091
            49  C1a C    25.0514  -10.8681
            50  C1b C    23.8940  -12.8266
            51  C1a C    23.8764  -16.7024
            52  O2a O    22.3740  -13.9373
            53  C1y C    20.5617  -15.3521
            54  C1y C    20.5617  -16.6324
            55  O2x O    19.4452  -14.7148
            56  C1y C    19.4452  -17.2754
            57  O1a O    21.6784  -17.2754
            58  C1y C    18.3346  -15.3521
            59  C1y C    18.3346  -16.6324
            60  O1a O    19.4452  -18.5615
            61  C1a C    17.2296  -14.7148
            62  O1a O    17.2296  -17.2754
BOND        65
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     7   3 1 #Up
            7     4   8 1
            8     4   9 1 #Up
            9     5  10 1
            10    5  11 1 #Down
            11    6  12 1
            12    6  13 1
            13    7  14 1
            14    7  15 1
            15   10  16 1 #Up
            16   14  17 1
            17   15  18 1
            18   19  16 1 #Down
            19   17  20 1
            20   17  21 1 #Down
            21   17  22 1 #Up
            22   18  23 1 #Down
            23   19  24 1
            24   19  25 1
            25   20  26 1 #Up
            26   24  27 1
            27   24  28 1 #Down
            28   25  29 1
            29   25  30 1 #Down
            30   27  31 1
            31   28  32 1
            32   29  33 1
            33   29  34 1 #Down
            34   31  35 1
            35   31  36 1 #Down
            36   32  37 2
            37   33  38 1
            38   35  39 1
            39   35  40 2
            40   38  41 1
            41   38  42 2
            42   39  43 2
            43   41  44 1
            44   43  45 1
            45   44  46 1
            46   44  47 1 #Down
            47   45  48 2
            48   45  49 1
            49   46  50 1 #Up
            50   47  51 1
            51   50  52 1
            52   53  52 1 #Up
            53   53  54 1
            54   53  55 1
            55   54  56 1
            56   54  57 1 #Down
            57   55  58 1
            58   56  59 1
            59   56  60 1 #Down
            60   58  61 1 #Up
            61   59  62 1 #Down
            62    8  10 1
            63   18  20 1
            64   46  48 1
            65   58  59 1

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