KEGG   COMPOUND: C20974
Entry
C20974                      Compound                               

Name
8-Demethyl-8-alpha-L-rhamnosyltetracenomycin C
Formula
C28H28O15
Exact mass
604.1428
Mol weight
604.5129
Structure
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00784  Elloramycin biosynthesis, 8-demethyltetracenomycin C => elloramycin A
Enzyme
2.1.1.305       2.4.1.331
Other DBs
PubChem: 254741433
KCF data

ATOM        43
            1   C2y C     4.9700  -14.1400
            2   C2x C     4.9700  -15.5400
            3   C5x C     6.1824  -16.2400
            4   C1z C     7.3949  -15.5400
            5   C1z C     7.3949  -14.1400
            6   C1y C     6.1824  -13.4400
            7   C5x C     8.6073  -16.2400
            8   C8y C     9.8197  -15.5400
            9   C8y C     9.8197  -14.1400
            10  C5x C     8.6073  -13.4400
            11  C8y C    11.0322  -16.2400
            12  C8y C    12.2446  -15.5400
            13  C8y C    12.2446  -14.1400
            14  C8x C    11.0322  -13.4400
            15  C8y C    13.4570  -16.2400
            16  C8y C    14.6695  -15.5400
            17  C8y C    14.6695  -14.1400
            18  C8x C    13.4570  -13.4400
            19  O2a O     3.7576  -13.4400
            20  C1a C     2.5621  -14.1304
            21  O5x O     8.6073  -12.0400
            22  O5x O     8.6073  -17.6400
            23  O5x O     6.1824  -17.6398
            24  O1a O     6.1824  -12.0402
            25  O1a O     7.3949  -12.7400
            26  O1a O     7.3949  -16.9400
            27  O1a O    11.0322  -17.6397
            28  C1a C    13.4570  -17.6399
            29  O2a O    15.9046  -13.4266
            30  C7a C    15.9046  -16.2534
            31  O7a O    17.1119  -15.5566
            32  C1a C    18.2931  -16.2389
            33  O6a O    15.9042  -17.6399
            34  C1y C    17.1170  -12.7266
            35  O2x O    18.3599  -13.4443
            36  C1y C    19.5724  -12.7444
            37  C1y C    19.5725  -11.3444
            38  C1y C    18.3297  -10.6267
            39  C1y C    17.1172  -11.3266
            40  C1a C    20.8033  -13.4556
            41  O1a O    18.3299   -9.2400
            42  O1a O    15.9353  -10.6440
            43  O1a O    20.8074  -10.6314
BOND        47
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17   12  15 1
            18   15  16 2
            19   16  17 1
            20   17  18 2
            21   13  18 1
            22    1  19 1
            23   19  20 1
            24   10  21 2
            25    7  22 2
            26    3  23 2
            27    6  24 1 #Up
            28    5  25 1 #Up
            29    4  26 1 #Up
            30   11  27 1
            31   15  28 1
            32   17  29 1
            33   16  30 1
            34   30  31 1
            35   31  32 1
            36   30  33 2
            37   34  29 1 #Up
            38   34  35 1
            39   35  36 1
            40   36  37 1
            41   37  38 1
            42   38  39 1
            43   34  39 1
            44   36  40 1 #Down
            45   38  41 1 #Down
            46   39  42 1 #Down
            47   37  43 1 #Up

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