KEGG   COMPOUND: C11973
Entry
C11973                      Compound                               
Name
Avermectin B2a monosaccharide
Formula
C41H62O12
Exact mass
746.4241
Mol weight
746.92
Structure
Reaction
Pathway
map00522  Biosynthesis of 12-, 14- and 16-membered macrolides
Enzyme
2.4.1.-
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK04 Macrolides and lactone polyketides
   C11973  Avermectin B2a monosaccharide
Other DBs
PubChem: 14134
ChEBI: 29542
NIKKAJI: J2.778.612J
LinkDB
KCF data

ATOM        53
            1   C1z C    31.5998  -16.4211
            2   O2x O    32.7894  -17.1088
            3   C1y C    33.9799  -16.4224
            4   C1y C    33.9807  -15.0481
            5   C1y C    32.7908  -14.3604
            6   C1x C    31.6003  -15.0470
            7   C1x C    28.0072  -15.7334
            8   C2x C    26.8076  -16.4211
            9   C2y C    25.6070  -15.7279
            10  C1y C    24.4066  -16.4211
            11  C1y C    24.4066  -17.8075
            12  C1y C    29.2066  -16.4211
            13  C1x C    31.6019  -17.8177
            14  O2x O    30.4101  -15.7331
            15  C1y C    30.3983  -18.5057
            16  C1x C    29.2082  -17.8099
            17  O7x O    30.3907  -19.8845
            18  C2x C    25.6104  -18.4986
            19  C2x C    25.6101  -19.8811
            20  C2x C    26.8055  -20.5649
            21  C2y C    26.7979  -21.9450
            22  C7x C    29.1961  -20.5780
            23  C1y C    29.1885  -21.9581
            24  C1z C    27.9941  -22.6366
            25  C1y C    27.9845  -24.0102
            26  C1y C    29.1694  -24.7055
            27  C2y C    30.3638  -24.0269
            28  C2x C    30.3735  -22.6534
            29  C1a C    25.6070  -14.3418
            30  O2a O    23.2059  -15.7279
            31  C1a C    23.2767  -18.6420
            32  C1x C    25.5954  -22.6345
            33  O1a O    28.0455  -21.2460
            34  O1a O    29.1597  -26.0916
            35  C1a C    31.5594  -24.7285
            36  O6a O    27.9968  -19.8829
            37  C1a C    35.1816  -14.3554
            38  C1c C    35.1803  -17.1161
            39  C1a C    35.1795  -18.5023
            40  C1b C    36.3812  -16.4235
            41  C1a C    37.5813  -17.1172
            42  O2x O    25.6442  -24.0185
            43  C1y C    19.6165  -16.4211
            44  C1y C    19.6165  -17.8075
            45  C1y C    20.8161  -18.5062
            46  C1x C    22.0155  -17.8075
            47  C1y C    22.0155  -16.4211
            48  O2x O    20.8161  -15.7334
            49  C1a C    18.4172  -15.7263
            50  O2a O    20.8161  -19.8924
            51  O1a O    18.4148  -18.4984
            52  C1a C    22.0168  -20.5856
            53  O1a O    32.7915  -12.9740
BOND        58
            1    23  24 1
            2    24  25 1
            3    25  26 1
            4    26  27 1
            5    27  28 2
            6    28  23 1
            7    15  13 1
            8     9  29 1
            9    13   1 1
            10   10  30 1 #Down
            11    1  14 1
            12   11  31 1 #Down
            13   14  12 1
            14   21  32 1
            15   12   7 1 #Up
            16   24  33 1 #Down
            17    7   8 1
            18   26  34 1 #Up
            19    1   2 1 #Down
            20   27  35 1
            21   15  16 1
            22   22  36 2
            23   22  17 1
            24    4  37 1 #Down
            25   15  17 1 #Up
            26    3  38 1 #Up
            27    2   3 1
            28   38  39 1
            29    3   4 1
            30   38  40 1
            31   18  19 2
            32   40  41 1
            33   19  20 1
            34   32  42 1
            35   25  42 1
            36    4   5 1
            37    8   9 2
            38    9  10 1
            39   20  21 2
            40   21  24 1
            41   23  22 1 #Down
            42   43  44 1
            43   44  45 1
            44   45  46 1
            45   46  47 1
            46   47  48 1
            47   48  43 1
            48   10  11 1
            49   43  49 1 #Down
            50   11  18 1
            51   45  50 1 #Down
            52    5   6 1
            53   44  51 1 #Up
            54    1   6 1 #Up
            55   50  52 1
            56   47  30 1 #Up
            57    5  53 1 #Down
            58   12  16 1

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