KEGG   COMPOUND: C12404Help
Entry
C12404                      Compound                               

Name
Urdamycinone B
Formula
C25H24O8
Exact mass
452.1471
Mol weight
452.4533
Structure
Mol fileKCF fileDB search
Reaction
Pathway
map01057  Biosynthesis of type II polyketide products
map01130  Biosynthesis of antibiotics
Other DBs
PubChem: 582794
ChEBI: 32283
3DMET: B04487
NIKKAJI: J1.043.914K
KCF data Show

ATOM        33
            1   C1z C    30.9376  -20.4801
            2   O1a O    32.4013  -20.1244
            3   C1a C    32.0836  -21.7415
            4   C1y C    20.2387  -14.0512
            5   C1y C    19.0424  -14.7591
            6   C1y C    19.0558  -16.1563
            7   C1x C    20.2691  -16.8326
            8   C1y C    21.4657  -16.1247
            9   O2x O    21.5186  -14.7405
            10  C8y C    22.6758  -16.7956
            11  O1a O    17.8606  -16.8662
            12  O1a O    17.8314  -14.0764
            13  C1a C    20.2271  -12.6611
            14  C8y C    29.6589  -18.2616
            15  C8y C    28.3823  -18.9992
            16  C5x C    28.3832  -20.4819
            17  C1x C    29.6609  -21.2082
            18  C1x C    30.9365  -18.9974
            19  C8y C    27.1056  -16.7768
            20  C8y C    27.1056  -18.2616
            21  C8x C    29.6630  -16.7768
            22  C8x C    28.3843  -16.0392
            23  C8x C    22.6704  -18.2709
            24  C8x C    23.7863  -18.8950
            25  C8y C    24.8928  -18.2709
            26  C5x C    25.9992  -18.8950
            27  C8y C    23.7768  -16.1526
            28  C8y C    24.8928  -16.7863
            29  C5x C    25.9896  -16.1431
            30  O1a O    23.7673  -14.7625
            31  O5x O    25.9801  -14.7530
            32  O5x O    25.9355  -20.2947
            33  O5x O    27.1717  -21.1553
BOND        37
            1     1   2 1 #Up
            2     1   3 1 #Down
            3     6  11 1 #Up
            4     5   6 1
            5     5  12 1 #Down
            6     6   7 1
            7    19  20 2
            8    20  15 1
            9    14  21 1
            10   21  22 2
            11   22  19 1
            12    4  13 1 #Up
            13    7   8 1
            14   23  24 1
            15    8   9 1
            16   24  25 2
            17    9   4 1
            18   25  26 1
            19   26  20 1
            20   23  10 2
            21   10  27 1
            22    8  10 1 #Up
            23   27  28 2
            24    4   5 1
            25   28  29 1
            26   29  19 1
            27   14  15 2
            28   27  30 1
            29   15  16 1
            30   29  31 2
            31   25  28 1
            32   16  17 1
            33   26  32 2
            34   17   1 1
            35   16  33 2
            36    1  18 1
            37   18  14 1

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