KEGG   COMPOUND: C20976Help
Entry
C20976                      Compound                               

Name
8-Demethyl-8-(2,3-di-O-methyl-alpha-L-rhamnosyl)tetracenomycin C
Formula
C30H32O15
Exact mass
632.1741
Mol weight
632.5661
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00784  Elloramycin biosynthesis, 8-demethyltetracenomycin C => elloramycin A
Enzyme
2.1.1.306       2.1.1.307
Other DBs
PubChem: 254741435
KCF data Show

ATOM        45
            1   C2y C    11.8909  -16.8521
            2   C2x C    11.8909  -18.2505
            3   C5x C    13.1019  -18.9497
            4   C1z C    14.3130  -18.2505
            5   C1z C    14.3130  -16.8521
            6   C1y C    13.1019  -16.1530
            7   C5x C    15.5239  -18.9497
            8   C8y C    16.7350  -18.2505
            9   C8y C    16.7350  -16.8521
            10  C5x C    15.5239  -16.1530
            11  C8y C    17.9460  -18.9497
            12  C8y C    19.1570  -18.2505
            13  C8y C    19.1570  -16.8521
            14  C8x C    17.9460  -16.1530
            15  C8y C    20.3680  -18.9497
            16  C8y C    21.5791  -18.2505
            17  C8y C    21.5791  -16.8521
            18  C8x C    20.3680  -16.1530
            19  O2a O    10.6800  -16.1530
            20  C1a C     9.4859  -16.8425
            21  O5x O    15.5239  -14.7546
            22  O5x O    15.5239  -20.3481
            23  O5x O    13.1019  -20.3479
            24  O1a O    13.1019  -14.7548
            25  O1a O    14.3130  -15.4538
            26  O1a O    14.3130  -19.6489
            27  O1a O    17.9460  -20.3478
            28  C1a C    20.3680  -20.3480
            29  O2a O    22.8127  -16.1396
            30  C7a C    22.8127  -18.9630
            31  O7a O    24.0186  -18.2671
            32  C1a C    25.1984  -18.9486
            33  O6a O    22.8123  -20.3480
            34  C1y C    24.0237  -15.4404
            35  O2x O    25.2652  -16.1572
            36  C1y C    26.4762  -15.4582
            37  C1y C    26.4763  -14.0598
            38  C1y C    25.2350  -13.3430
            39  C1y C    24.0239  -14.0420
            40  C1a C    27.7057  -16.1685
            41  O2a O    25.2352  -11.9579
            42  O2a O    22.8434  -13.3603
            43  O1a O    27.7097  -13.3477
            44  C1a C    21.6046  -14.0756
            45  C1a C    26.4681  -11.2458
BOND        49
            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
            49   41  45 1

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