KEGG   COMPOUND: C18327Help
Entry
C18327                      Compound                               

Name
7,9,12-Octaketide intermediate 1
Formula
C16H17O8SR
Structure
Mol fileKCF fileDB search
Comment
Generic compound in reaction hierarchy
Reaction
Pathway
map01056  Biosynthesis of type II polyketide backbone
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00778  Type II polyketide backbone biosynthesis, acyl-CoA + malonyl-CoA => polyketide
Enzyme
1.1.1.-
Other DBs
PubChem: 124489001
ChEBI: 81673
KCF data Show

ATOM        26
            1   C1x C    20.8579  -16.1772
            2   C5x C    20.8579  -14.3278
            3   C1x C    22.0910  -13.5741
            4   C1z C    23.3240  -14.3278
            5   C1y C    23.3240  -16.1772
            6   C5x C    22.0910  -16.8622
            7   C1b C    24.5570  -13.5741
            8   C5a C    25.7901  -14.3278
            9   C1b C    25.7901  -16.1772
            10  C5a C    24.5570  -16.8622
            11  C1b C    27.0916  -13.5741
            12  C5a C    28.2561  -14.3278
            13  C5a C    27.0916  -16.8622
            14  C1b C    29.4207  -13.5741
            15  C5a C    30.6537  -14.3278
            16  O5x O    22.0910  -18.3009
            17  O5a O    24.5570  -18.3009
            18  O5a O    27.0916  -18.3009
            19  O5a O    28.2561  -15.2868
            20  O5a O    30.6537  -15.2868
            21  O5a O    25.7901  -15.2868
            22  C1a C    28.2561  -16.1772
            23  O5x O    19.6935  -13.6427
            24  S2a S    31.8868  -13.6427
            25  O1a O    23.3240  -12.9491
            26  R   R    33.2868  -13.6427
BOND        26
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     5   6 1
            5     1   6 1
            6     4   7 1
            7     7   8 1
            8     9  10 1
            9     5  10 1
            10    8  11 1
            11   11  12 1
            12    9  13 1
            13   12  14 1
            14   14  15 1
            15    6  16 2
            16   10  17 2
            17   13  18 2
            18   12  19 2
            19   15  20 2
            20    8  21 2
            21   13  22 1
            22    2  23 2
            23   15  24 1
            24    4   5 1
            25    4  25 1
            26   24  26 1

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