KEGG   COMPOUND: C12348Help
Entry
C12348                      Compound                               

Name
3,5,7,9,11,13,15-Heptaoxo-hexadecanoyl-[acp]
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
2.3.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0706 Fatty acyl ACPs
    C12348  3,5,7,9,11,13,15-Heptaoxo-hexadecanoyl-[acp]
BRITE hierarchy
Other DBs
PubChem: 582738
ChEBI: 31101
LIPIDMAPS: LMFA07060021
KCF data Show

ATOM        26
            1   S2a S    32.8759  -17.6200
            2   C1b C    30.4629  -17.6297
            3   C1a C    13.5068  -17.6722
            4   C5a C    14.7231  -16.9702
            5   O5a O    14.7188  -15.5658
            6   C1b C    15.9295  -17.6622
            7   C5a C    17.1459  -16.9602
            8   C1b C    18.3522  -17.6525
            9   C5a C    19.5686  -16.9502
            10  C1b C    20.7752  -17.6525
            11  C5a C    21.9816  -16.9405
            12  C1b C    23.1880  -17.6425
            13  O5a O    17.1416  -15.5559
            14  O5a O    19.6343  -15.5461
            15  O5a O    21.9773  -15.5461
            16  C5a C    24.4043  -16.9405
            17  C1b C    25.6110  -17.6326
            18  C5a C    26.8273  -16.9305
            19  C1b C    28.0337  -17.6326
            20  C5a C    29.2501  -16.9206
            21  O5a O    24.4001  -15.5362
            22  O5a O    26.8230  -15.5262
            23  O5a O    29.2458  -15.5262
            24  C5a C    31.6631  -16.9206
            25  O5a O    31.6555  -15.5165
            26  R   R    34.2759  -17.6200
BOND        25
            1     3   4 1
            2    11  15 2
            3     8   9 1
            4    12  16 1
            5     4   6 1
            6    16  17 1
            7     9  10 1
            8    17  18 1
            9    18  19 1
            10   10  11 1
            11   19  20 1
            12   20   2 1
            13    6   7 1
            14   16  21 2
            15   11  12 1
            16   18  22 2
            17    4   5 2
            18   20  23 2
            19    7  13 2
            20    2  24 1
            21   24   1 1
            22    7   8 1
            23   24  25 2
            24    9  14 2
            25    1  26 1

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