KEGG   COMPOUND: C18328Help
Entry
C18328                      Compound                               

Name
7,9,12-Octaketide intermediate 2
Formula
C16H19O8SR
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.-         4.2.1.-
Other DBs
PubChem: 124489002
ChEBI: 81674
KCF data Show

ATOM        26
            1   C1y C    14.1400  -17.5000
            2   C1x C    14.1400  -18.9000
            3   C5x C    15.3524  -19.6000
            4   C1y C    16.5649  -18.9000
            5   C1z C    16.5649  -17.5000
            6   C1x C    15.3524  -16.8000
            7   C5a C    18.3624  -19.9500
            8   C1b C    19.5749  -19.2500
            9   C5a C    20.7873  -19.9500
            10  C1a C    21.9997  -19.2500
            11  C1b C    18.2224  -16.2400
            12  C5a C    19.4349  -16.9400
            13  C1b C    20.6473  -16.2400
            14  C5a C    21.8597  -16.9400
            15  C1b C    23.0722  -16.2400
            16  C5a C    24.2846  -16.9400
            17  S2a S    25.4970  -16.2400
            18  O1a O    12.9276  -16.8000
            19  O1a O    16.5649  -16.1000
            20  O5a O    18.3589  -21.3499
            21  O5x O    15.3524  -20.9998
            22  O5a O    20.7873  -21.3500
            23  O5a O    19.4349  -18.1998
            24  O5a O    21.8597  -18.1999
            25  O5a O    24.2846  -18.2000
            26  R   R    26.8970  -16.2400
BOND        26
            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     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18    1  18 1
            19    5  19 1
            20    7  20 2
            21    3  21 2
            22    9  22 2
            23   12  23 2
            24   14  24 2
            25   16  25 2
            26   17  26 1

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