KEGG   COMPOUND: C01212
Entry
C01212                      Compound                               
Name
UDP-N-acetylmuramoyl-L-alanine;
UDP-N-acetyl-alpha-D-muramoyl-L-alanine
Formula
C23H36N4O20P2
Exact mass
750.1398
Mol weight
750.49
Structure
Reaction
Pathway
map00550  Peptidoglycan biosynthesis
map01100  Metabolic pathways
Enzyme
6.3.2.8         6.3.2.9         6.3.2.53
Other DBs
PubChem: 4434
ChEBI: 84726
PDB-CCD: UMA[PDBj]
NIKKAJI: J890.604A
LinkDB
KCF data

ATOM        49
            1   C1y C    34.1922  -20.5291
            2   C1y C    34.1922  -21.8985
            3   O2x O    33.0036  -19.8532
            4   O2b O    35.3694  -19.8532
            5   C1y C    33.0036  -22.5861
            6   N1b N    35.5267  -23.1281
            7   C1y C    31.8324  -20.5291
            8   P1b P    36.7270  -19.8532
            9   C1y C    31.8324  -21.8985
            10  O2a O    33.0036  -23.9497
            11  C5a C    35.5267  -24.4914
            12  C1b C    30.6613  -19.8532
            13  O2c O    38.0789  -19.8532
            14  O1c O    36.7270  -18.4955
            15  O1c O    36.7270  -21.2050
            16  O1a O    30.6553  -22.5686
            17  C1c C    31.8265  -24.6197
            18  C1a C    36.7037  -25.1616
            19  O5a O    34.3555  -25.1675
            20  O1a O    30.6496  -18.4546
            21  P1b P    39.4307  -19.8532
            22  C5a C    31.8207  -25.9775
            23  C1a C    30.6553  -23.9437
            24  O2b O    40.7943  -19.8532
            25  O1c O    39.4366  -18.4955
            26  O1c O    39.4307  -21.2050
            27  N1b N    30.3290  -27.1311
            28  O5a O    32.9920  -26.6534
            29  C1b C    41.0856  -21.1817
            30  C1c C    30.3116  -28.4713
            31  C1y C    42.3734  -21.5955
            32  C6a C    29.0122  -28.9142
            33  C1a C    31.4535  -29.2405
            34  O2x O    43.4514  -20.8030
            35  C1y C    42.8104  -22.8832
            36  O6a O    27.8992  -28.1276
            37  O6a O    29.0122  -30.2718
            38  C1y C    44.5645  -21.6187
            39  C1y C    44.1565  -22.8832
            40  O1a O    42.0180  -23.9846
            41  N4y N    45.6248  -19.4102
            42  O1a O    44.9665  -23.9787
            43  C8y C    44.4536  -18.7169
            44  C8x C    46.8136  -18.7169
            45  N4x N    44.4536  -17.3417
            46  O5x O    43.2766  -19.3871
            47  C8x C    46.8136  -17.3417
            48  C8y C    45.6307  -16.6658
            49  O5x O    45.6248  -15.3199
BOND        51
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    6  11 1
            11    7  12 1 #Up
            12    8  13 1
            13    8  14 1
            14    8  15 2
            15    9  16 1 #Down
            16   10  17 1
            17   11  18 1
            18   11  19 2
            19   12  20 1
            20   13  21 1
            21   17  22 1
            22   17  23 1 #Up
            23   21  24 1
            24   21  25 1
            25   21  26 2
            26   22  27 1
            27   22  28 2
            28   24  29 1
            29   30  27 1 #Up
            30   31  29 1 #Up
            31   30  32 1
            32   30  33 1
            33   31  34 1
            34   31  35 1
            35   32  36 1
            36   32  37 2
            37   34  38 1
            38   35  39 1
            39   35  40 1 #Down
            40   38  41 1 #Up
            41   39  42 1 #Down
            42   41  43 1
            43   41  44 1
            44   43  45 1
            45   43  46 2
            46   44  47 2
            47   45  48 1
            48   48  49 2
            49    7   9 1
            50   38  39 1
            51   47  48 1

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