KEGG   COMPOUND: C18641
Entry
C18641                      Compound                               

Name
15-Demethoxy-epsilon-rhodomycin
Formula
C29H33NO11
Exact mass
571.2054
Mol weight
571.5724
Structure
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01110  Biosynthesis of secondary metabolites
Enzyme
Other DBs
PubChem: 124489315
ChEBI: 81878
KCF data

ATOM        41
            1   C1y C    29.5320  -20.1718
            2   C1y C    29.5320  -21.5529
            3   C1y C    30.7059  -22.2435
            4   C1x C    31.9489  -21.5529
            5   C1y C    31.9489  -20.1718
            6   O2x O    30.7059  -19.4812
            7   C1a C    28.3580  -19.4812
            8   O1a O    28.3580  -22.2435
            9   N1c N    30.7059  -23.6246
            10  C1a C    29.5320  -24.3151
            11  C1a C    31.8798  -24.3151
            12  O2a O    33.1228  -19.4812
            13  C8x C    24.7671  -14.7164
            14  C8x C    24.7671  -16.0975
            15  C8y C    25.9411  -16.7881
            16  C8y C    27.1841  -16.0975
            17  C8y C    27.1841  -14.7164
            18  C8x C    25.9411  -14.0259
            19  C5x C    28.3580  -16.7881
            20  C8y C    29.5320  -16.0975
            21  C8y C    29.5320  -14.7164
            22  C5x C    28.3580  -14.0259
            23  C8y C    30.7750  -16.7881
            24  C8y C    31.9489  -16.0975
            25  C8y C    31.9489  -14.7164
            26  C8y C    30.7750  -14.0259
            27  C1y C    33.1228  -16.7881
            28  C1x C    34.3658  -16.0975
            29  C1z C    34.3658  -14.7164
            30  C1y C    33.1228  -14.0259
            31  O5x O    28.3580  -12.6448
            32  O5x O    28.3580  -18.1692
            33  O1a O    25.9411  -18.1692
            34  O1a O    30.7750  -18.1692
            35  C6a C    33.1228  -12.6448
            36  O6a O    31.9489  -11.9542
            37  O6a O    34.2968  -11.9542
            38  O1a O    35.5398  -15.4070
            39  C1b C    35.5398  -14.0259
            40  C1a C    35.5398  -12.6448
            41  O1a O    30.7920  -12.6000
BOND        45
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     1   7 1 #Down
            8     2   8 1 #Down
            9     3   9 1 #Down
            10    9  10 1
            11    9  11 1
            12    5  12 1 #Up
            13   13  14 1
            14   14  15 2
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   13  18 2
            19   16  19 1
            20   19  20 1
            21   20  21 2
            22   21  22 1
            23   17  22 1
            24   20  23 1
            25   23  24 2
            26   24  25 1
            27   25  26 2
            28   21  26 1
            29   24  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   25  30 1
            34   22  31 2
            35   19  32 2
            36   15  33 1
            37   23  34 1
            38   27  12 1 #Down
            39   30  35 1 #Up
            40   35  36 2
            41   35  37 1
            42   29  38 1 #Down
            43   29  39 1 #Up
            44   39  40 1
            45   26  41 1

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