KEGG   COMPOUND: C18629Help
Entry
C18629                      Compound                               

Name
Deoxynogalonate;
12-Deoxynogalonic acid
Formula
C20H16O7
Exact mass
368.0896
Mol weight
368.3368
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00778  Type II polyketide backbone biosynthesis, acyl-CoA + malonyl-CoA => polyketide
M00781  Nogalavinone/aklavinone biosynthesis, deoxynogalonate/deoxyaklanonate => nogalavinone/aklavinone
Enzyme
Other DBs
PubChem: 124489303
ChEBI: 81873
LinkDB All DBs
KCF data Show

ATOM        27
            1   C8x C     7.8400  -13.8600
            2   C8x C     7.8400  -15.4700
            3   C8y C     9.0524  -16.1700
            4   C8y C    10.2649  -15.4700
            5   C8y C    10.2649  -13.8600
            6   C8x C     9.0524  -13.1600
            7   C5x C    11.4773  -16.1700
            8   C8y C    12.6897  -15.4700
            9   C8y C    12.6897  -13.8600
            10  C1x C    11.4773  -13.1600
            11  C8y C    13.9022  -16.1700
            12  C8y C    15.1146  -15.4700
            13  C8y C    15.1146  -13.8600
            14  C8x C    13.9022  -13.1600
            15  C1b C    16.3324  -13.1600
            16  C6a C    17.5449  -13.8600
            17  O6a O    18.7573  -13.1600
            18  C5a C    16.3324  -16.1700
            19  C1b C    17.5449  -15.4700
            20  C5a C    18.7573  -16.1700
            21  C1a C    19.9697  -15.4700
            22  O5a O    16.3338  -17.5698
            23  O5a O    18.7573  -17.5700
            24  O6a O    17.5672  -14.7123
            25  O5x O    11.4773  -17.5700
            26  O1a O     9.0524  -17.5698
            27  O1a O    13.9022  -17.5697
BOND        29
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17   13  15 1
            18   15  16 1
            19   16  17 1
            20   12  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   18  22 2
            25   20  23 2
            26   16  24 2
            27    7  25 2
            28    3  26 1
            29   11  27 1

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