KEGG   COMPOUND: C20975
Entry
C20975                      Compound                               

Name
8-Demethyl-8-(2-O-methyl-alpha-L-rhamnosyl)tetracenomycin C
Formula
C29H30O15
Exact mass
618.1585
Mol weight
618.5395
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       2.1.1.306
Other DBs
PubChem: 254741434
KCF data

ATOM        44
            1   C2y C    11.8965  -16.8600
            2   C2x C    11.8965  -18.2590
            3   C5x C    13.1080  -18.9586
            4   C1z C    14.3197  -18.2590
            5   C1z C    14.3197  -16.8600
            6   C1y C    13.1080  -16.1605
            7   C5x C    15.5312  -18.9586
            8   C8y C    16.7428  -18.2590
            9   C8y C    16.7428  -16.8600
            10  C5x C    15.5312  -16.1605
            11  C8y C    17.9544  -18.9586
            12  C8y C    19.1660  -18.2590
            13  C8y C    19.1660  -16.8600
            14  C8x C    17.9544  -16.1605
            15  C8y C    20.3775  -18.9586
            16  C8y C    21.5892  -18.2590
            17  C8y C    21.5892  -16.8600
            18  C8x C    20.3775  -16.1605
            19  O2a O    10.6850  -16.1605
            20  C1a C     9.4903  -16.8504
            21  O5x O    15.5312  -14.7615
            22  O5x O    15.5312  -20.3576
            23  O5x O    13.1080  -20.3574
            24  O1a O    13.1080  -14.7617
            25  O1a O    14.3197  -15.4610
            26  O1a O    14.3197  -19.6581
            27  O1a O    17.9544  -20.3573
            28  C1a C    20.3775  -20.3575
            29  O2a O    22.8234  -16.1471
            30  C7a C    22.8234  -18.9719
            31  O7a O    24.0298  -18.2756
            32  C1a C    25.2102  -18.9575
            33  O6a O    22.8230  -20.3575
            34  C1y C    24.0349  -15.4476
            35  O2x O    25.2770  -16.1648
            36  C1y C    26.4886  -15.4654
            37  C1y C    26.4887  -14.0664
            38  C1y C    25.2468  -13.3492
            39  C1y C    24.0351  -14.0486
            40  C1a C    27.7186  -16.1761
            41  O1a O    25.2470  -11.9635
            42  O2a O    22.8541  -13.3665
            43  O1a O    27.7227  -13.3539
            44  C1a C    21.6147  -14.0822
BOND        48
            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
            48   42  44 1

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