KEGG   COMPOUND: C12414Help
Entry
C12414                      Compound                               

Name
Urdamycin G;
Aggreticin;
OM 4842
Formula
C37H46O14
Exact mass
714.2888
Mol weight
714.7527
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01130  Biosynthesis of antibiotics
Enzyme
2.4.1.-
Brite
Glycosides [BR:br08021]
 O-glycosides
  Anthraquinone glycosides
   C12414  Urdamycin G
BRITE hierarchy
Other DBs
CAS: 115626-67-0
PubChem: 582804
ChEBI: 32282
3DMET: B04497
NIKKAJI: J227.738G
KCF data Show

ATOM        51
            1   C1y C    19.8311  -15.7525
            2   C1x C    19.8311  -17.0811
            3   C1x C    20.9872  -17.7500
            4   C1y C    22.1341  -17.0811
            5   O2x O    22.1341  -15.7525
            6   C1y C    20.9872  -15.0927
            7   C1a C    20.9894  -13.7643
            8   O1a O    18.6822  -15.0855
            9   O2a O    23.2862  -17.7431
            10  C1y C    25.5589  -15.0525
            11  C1y C    24.4155  -15.7291
            12  C1y C    24.4285  -17.0644
            13  C1x C    25.5881  -17.7109
            14  C1y C    26.7315  -17.0343
            15  O2x O    26.7153  -15.7113
            16  C8y C    27.8881  -17.6755
            17  O1a O    23.2580  -15.0764
            18  C1a C    25.5480  -13.7239
            19  C1z C    34.5623  -19.0765
            20  C1z C    33.3421  -19.7815
            21  C5x C    33.3432  -21.1987
            22  C1x C    34.5644  -21.8928
            23  C1z C    35.7846  -21.1971
            24  C1x C    35.7836  -19.7799
            25  C2y C    32.1219  -17.6575
            26  C2y C    32.1219  -19.0765
            27  C2x C    34.5665  -17.6575
            28  C2x C    33.3442  -16.9525
            29  C8x C    27.8828  -19.0855
            30  C8x C    28.9496  -19.6821
            31  C8y C    30.0069  -19.0855
            32  C5x C    31.0644  -19.6821
            33  C8y C    28.9403  -17.0609
            34  C8y C    30.0069  -17.6665
            35  C5x C    31.0553  -17.0519
            36  O1a O    28.9316  -15.7323
            37  O5x O    31.0466  -15.7232
            38  O5x O    31.0705  -20.8798
            39  O5x O    32.1854  -21.9823
            40  O1a O    37.3826  -20.2879
            41  C1a C    37.3826  -22.0637
            42  O1a O    35.7102  -18.4077
            43  O2a O    30.4136  -22.7552
            44  C1y C    26.9609  -23.4238
            45  C1y C    26.9609  -24.7524
            46  C1x C    28.1170  -25.4215
            47  C1x C    29.2639  -24.7524
            48  C1y C    29.2639  -23.4238
            49  O2x O    28.1170  -22.7642
            50  O1a O    25.8101  -25.4162
            51  C1a C    25.8120  -22.7568
BOND        57
            1    10  11 1
            2    11  12 1
            3    12  13 1
            4    25  26 2
            5    26  20 1
            6    19  27 1
            7    27  28 2
            8    28  25 1
            9    13  14 1
            10   14  15 1
            11   29  30 1
            12   15  10 1
            13   30  31 2
            14    1   2 1
            15   31  32 1
            16   32  26 1
            17   29  16 2
            18   14  16 1 #Up
            19   16  33 1
            20   12   9 1 #Up
            21   33  34 2
            22    1   8 1 #Down
            23   34  35 1
            24   35  25 1
            25   11  17 1 #Down
            26   33  36 1
            27    2   3 1
            28   35  37 2
            29   31  34 1
            30   10  18 1 #Up
            31   32  38 2
            32    4   9 1 #Up
            33   21  39 2
            34    3   4 1
            35   23  40 1 #Up
            36    4   5 1
            37   23  41 1 #Down
            38    5   6 1
            39   19  42 1 #Up
            40    6   1 1
            41   20  43 1 #Up
            42   19  20 1
            43   20  21 1
            44   21  22 1
            45   22  23 1
            46   23  24 1
            47   44  45 1
            48   45  46 1
            49   46  47 1
            50   47  48 1
            51   48  49 1
            52   49  44 1
            53   48  43 1 #Up
            54   24  19 1
            55   45  50 1 #Down
            56    6   7 1 #Down
            57   44  51 1 #Down

» Japanese version

DBGET integrated database retrieval system