KEGG   COMPOUND: C12416Help
Entry
C12416                      Compound                               

Name
Nogalonate;
Nogalonic acid
Formula
C20H14O8
Exact mass
382.0689
Mol weight
382.3204
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00781  Nogalavinone/aklavinone biosynthesis, deoxynogalonate/deoxyaklanonate => nogalavinone/aklavinone
Enzyme
1.13.12.22      2.1.1.-
Other DBs
PubChem: 582806
ChEBI: 31915
3DMET: B04499
NIKKAJI: J2.231.100J
LinkDB All DBs
KCF data Show

ATOM        28
            1   O6a O    29.9602  -15.7943
            2   C8x C    25.1481  -15.8643
            3   C8x C    19.1505  -16.5463
            4   C8x C    20.3488  -15.8522
            5   C8y C    21.5471  -16.5559
            6   C5x C    22.7453  -15.8616
            7   C8y C    23.9436  -16.5655
            8   C8x C    19.1464  -18.0040
            9   C8y C    26.3498  -16.5655
            10  C1b C    27.5481  -15.8012
            11  C6a C    28.7560  -16.4955
            12  O6a O    28.7573  -17.5389
            13  C8y C    20.3488  -18.6984
            14  C8y C    21.5377  -18.0040
            15  C5x C    22.7453  -18.7080
            16  C8y C    23.9343  -18.0136
            17  C8y C    25.1419  -18.7173
            18  O1a O    20.3394  -20.0868
            19  O5x O    22.7360  -20.0964
            20  O1a O    25.1326  -20.1060
            21  C8y C    26.3402  -17.8139
            22  O5x O    22.7472  -14.4825
            23  C5a C    27.5385  -18.7873
            24  C1b C    28.7464  -18.1026
            25  C5a C    29.9447  -18.7969
            26  C1a C    31.1430  -18.1026
            27  O5a O    27.5385  -20.1853
            28  O5a O    29.9351  -20.1853
BOND        30
            1     3   8 1
            2    14  15 1
            3     3   4 2
            4    15  16 1
            5     2   9 2
            6    16  17 1
            7    17  21 2
            8     5   6 1
            9    13  18 1
            10    9  10 1
            11   15  19 2
            12   17  20 1
            13    5  14 2
            14    7  16 2
            15   10  11 1
            16    9  21 1
            17   11   1 1
            18    6  22 2
            19    6   7 1
            20   11  12 2
            21   23  24 1
            22    7   2 1
            23   24  25 1
            24    8  13 2
            25   25  26 1
            26    4   5 1
            27   23  27 2
            28   13  14 1
            29   25  28 2
            30   21  23 1

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