KEGG   COMPOUND: C12384Help
Entry
C12384                      Compound                               

Name
Premithramycin A1
Formula
C27H28O12
Exact mass
544.1581
Mol weight
544.504
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00782  Mithramycin biosynthesis, 4-demethylpremithramycinone => mithramycin
Enzyme
2.4.1.-
Other DBs
PubChem: 582774
ChEBI: 32046
3DMET: B04469
NIKKAJI: J1.260.374F
LinkDB All DBs
KCF data Show

ATOM        39
            1   C1y C    26.2395  -23.2553
            2   C1y C    26.2395  -21.9091
            3   O2x O    27.4043  -21.2266
            4   C1y C    28.5692  -21.9091
            5   C1x C    28.5692  -23.2553
            6   C1y C    27.4043  -23.9190
            7   O2a O    29.7397  -21.2341
            8   C1a C    25.0703  -21.2320
            9   O1a O    25.0723  -23.9265
            10  O1a O    27.4066  -25.2745
            11  O1a O    33.2152  -16.0527
            12  C1x C    28.6081  -16.0527
            13  C8y C    22.8479  -16.7041
            14  C8x C    24.0044  -16.0407
            15  C8y C    25.1515  -16.7136
            16  C8x C    26.2986  -16.0500
            17  C8y C    27.4551  -16.7136
            18  C8x C    22.8534  -18.0298
            19  C1y C    29.7586  -16.7232
            20  C1y C    30.9151  -16.0595
            21  C2y C    32.0622  -16.7232
            22  C8y C    24.0044  -18.6935
            23  C8y C    25.1419  -18.0394
            24  C8y C    26.2891  -18.7030
            25  C8y C    27.4455  -18.0489
            26  C5x C    28.6022  -18.7030
            27  C1z C    29.7491  -18.0582
            28  C5x C    30.9058  -18.7123
            29  C2y C    32.0526  -18.0582
            30  C5a C    33.2093  -18.7219
            31  C1a C    34.3562  -18.0582
            32  O1a O    23.9950  -20.0205
            33  O1a O    26.2891  -20.0301
            34  O5x O    28.6626  -20.0396
            35  O5x O    30.9662  -20.0396
            36  O5a O    33.1998  -20.0490
            37  O1a O    21.6915  -16.0407
            38  O2a O    30.9058  -14.7133
            39  C1a C    32.0697  -14.0369
BOND        43
            1    20  21 1
            2    21  11 1
            3     4   5 1
            4    18  22 1
            5     5   6 1
            6    22  23 2
            7     6   1 1
            8    23  24 1
            9    24  25 2
            10   13  14 1
            11   25  26 1
            12    4   7 1 #Up
            13   26  27 1
            14   14  15 2
            15   27  28 1
            16    1   2 1
            17   28  29 1
            18   15  16 1
            19   29  30 1
            20    2   8 1 #Up
            21   30  31 1
            22   16  17 2
            23   22  32 1
            24   17  12 1
            25   24  33 1
            26    2   3 1
            27   26  34 2
            28   13  18 2
            29   28  35 2
            30    1   9 1 #Down
            31   30  36 2
            32   12  19 1
            33   13  37 1
            34   15  23 1
            35   17  25 1
            36   19  27 1
            37   21  29 2
            38    3   4 1
            39   27   7 1 #Down
            40   19  20 1
            41   20  38 1 #Down
            42    6  10 1 #Up
            43   38  39 1

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