KEGG   COMPOUND: C12442
Entry
C12442                      Compound                               
Name
C-9 Reduced nonaketamide;
18-Carbamoyl-9-hydroxy-3,5,7,11,13,15,17-octaoxo-octadecanoyl-[acp]
Formula
C19H22NO10SR
Structure
Comment
Generic compound in reaction hierarchy
Reaction
R06642 R09187
Pathway
map00253  Tetracycline biosynthesis
map01056  Biosynthesis of type II polyketide backbone
map01100  Metabolic pathways
map01110  Biosynthesis of secondary metabolites
Module
M00778  Type II polyketide backbone biosynthesis, acyl-CoA + malonyl-CoA => polyketide
Enzyme
1.1.1.-         4.2.1.-
Other DBs
PubChem: 582832
ChEBI: 31061
LinkDB
KCF data

ATOM        32
            1   S2a S    49.4967  -23.8204
            2   C1b C    47.0767  -23.8300
            3   C1b C    27.7009  -23.8801
            4   C5a C    28.9063  -23.1779
            5   C1b C    30.1210  -23.8705
            6   C5a C    31.3263  -23.1683
            7   O5a O    31.3222  -21.7636
            8   O5a O    28.9022  -21.7732
            9   C1b C    32.5410  -23.8612
            10  C5a C    33.7557  -23.1587
            11  C1b C    34.9706  -23.8612
            12  C5a C    36.1757  -23.1494
            13  C1b C    37.3811  -23.8516
            14  C1c C    38.5864  -23.1494
            15  C1b C    39.8107  -23.8420
            16  O5a O    33.7516  -21.7543
            17  O5a O    36.1716  -21.7543
            18  O1a O    38.5917  -21.7447
            19  C5a C    41.0158  -23.1398
            20  C1b C    42.2307  -23.8420
            21  C5a C    43.4358  -23.1303
            22  C1b C    44.6601  -23.8327
            23  C5a C    45.8654  -23.1303
            24  O5a O    41.0213  -21.7352
            25  O5a O    43.4413  -21.7352
            26  O5a O    45.8613  -21.7258
            27  C5a C    48.2759  -23.1209
            28  O5a O    48.2784  -21.7163
            29  C5a C    26.4899  -23.1874
            30  N1a N    25.2846  -23.8896
            31  O5a O    26.4844  -21.7923
            32  R   R    50.8967  -23.8204
BOND        31
            1    12  17 2
            2     9  10 1
            3    14  18 1
            4    15  19 1
            5    10  11 1
            6    19  20 1
            7     6   7 2
            8    20  21 1
            9    11  12 1
            10   21  22 1
            11    4   5 1
            12   22  23 1
            13   23   2 1
            14   12  13 1
            15   19  24 2
            16    4   8 2
            17   21  25 2
            18   13  14 1
            19   23  26 2
            20    3   4 1
            21    2  27 1
            22   27   1 1
            23   14  15 1
            24   27  28 2
            25    6   9 1
            26    3  29 1
            27   10  16 2
            28   29  30 1
            29    5   6 1
            30   29  31 2
            31    1  32 1

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